data_2mxt_residue 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 2mxt _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.445 0 N-CA-C 110.19 -1.164 . . . . 62.21 110.19 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.48 -173.41 2.52 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.743 1.217 . . . . 63.24 111.684 -169.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -44.18 -45.04 8.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.162 2.185 . . . . 73.14 110.899 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.73 -34.44 78.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.632 1.173 . . . . 75.31 110.649 -170.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.62 -50.04 69.05 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.17 0.988 . . . . 74.42 112.133 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.97 -40.59 91.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.082 -0.485 . . . . 73.52 111.253 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.3 m -61.65 -45.51 93.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.788 0.435 . . . . 72.42 110.294 175.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.3 mt -61.4 -43.15 99.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.493 0.717 . . . . 74.33 111.993 -176.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.4 mt -57.77 -40.33 79.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.587 -0.523 . . . . 64.51 109.587 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -82.09 -20.27 38.5 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.646 0.26 . . . . 74.11 111.26 -172.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.41 18.91 0.14 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.643 2.777 . . . . 75.21 111.895 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.18 -0.43 81.52 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 125.157 1.36 . . . . 74.51 114.115 168.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 90.8 mt -77.08 147.93 77.59 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.863 1.332 . . . . 65.12 111.107 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.32 156.93 60.54 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.152 1.901 . . . . 64.34 109.441 165.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.47 -42.93 97.24 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 124.127 0.971 . . . . 71.11 108.909 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.1 -37.15 74.0 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 118.608 -0.71 . . . . 72.31 111.602 -174.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.1 t -78.58 -47.27 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.446 1.098 . . . . 73.13 108.287 -179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.16 70.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.173 0.589 . . . . 71.22 111.578 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.41 -55.35 22.33 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.881 1.273 . . . . 74.33 110.98 178.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -45.25 83.53 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.022 0.529 . . . . 74.13 110.101 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.09 -36.08 81.2 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.095 0.558 . . . . 74.42 111.685 -167.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.61 -45.59 73.68 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.486 1.115 . . . . 74.13 110.521 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.84 -19.75 65.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 114.26 1.208 . . . . 73.32 114.26 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.11 -27.91 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 108.746 -0.835 . . . . 71.32 108.746 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.65 -23.12 24.34 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.649 1.18 . . . . 75.13 111.656 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.9 t -73.14 -33.56 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 123.624 0.77 . . . . 75.11 111.262 177.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.44 17.59 15.77 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.509 0.929 . . . . 71.53 113.509 -164.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.21 33.41 78.17 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 123.781 0.705 . . . . 75.45 114.343 170.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -94.48 -75.03 0.52 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 127.295 2.238 . . . . 74.24 108.883 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.6 m -123.32 163.66 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.64 1.176 . . . . 74.53 110.057 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.86 160.73 25.96 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.901 0.481 . . . . 74.35 110.492 167.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.67 -28.08 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.566 -0.709 . . . . 62.41 110.169 166.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.2 p -81.69 -1.05 45.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.098 0.959 . . . . 74.34 112.272 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.47 -13.24 61.39 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.354 -0.841 . . . . 75.32 112.95 -171.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.35 156.99 21.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.624 1.169 . . . . 71.54 111.246 -174.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -91.35 163.21 14.29 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.398 1.079 . . . . 42.31 108.186 164.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -61.87 -28.35 69.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.764 0.426 . . . . 51.35 110.589 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -62.63 -29.92 70.98 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.795 -1.191 . . . . 74.11 111.059 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.87 -47.09 49.07 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.644 -0.693 . . . . 64.31 109.824 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.0 mm -57.22 -38.69 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.587 0.63 . . . . 73.42 110.224 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.44 -54.44 8.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.101 0.56 . . . . 73.33 110.573 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.2 64.65 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.26 0.467 . . . . 72.54 112.26 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 mt -63.11 -42.9 99.66 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.757 1.223 . . . . 74.43 111.714 171.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -24.34 62.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.767 1.167 . . . . 63.15 110.957 173.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -76.84 34.6 0.15 Allowed 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.155 -0.966 . . . . 64.21 111.503 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -134.49 151.93 51.46 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.286 1.034 . . . . 74.13 108.403 165.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -78.86 176.73 9.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.191 0.52 . . . . 64.53 109.784 161.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -61.3 2.51 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 125.863 1.665 . . . . 73.25 111.32 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -67.07 -24.48 65.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.081 0.552 . . . . 55.03 111.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.52 -69.64 1.22 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 109.331 -1.508 . . . . 62.24 109.331 170.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.43 -41.27 76.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.26 1.424 . . . . 65.25 111.503 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.9 mt -62.03 -39.4 92.19 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 118.37 -0.824 . . . . 75.42 111.501 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.29 84.42 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.572 0.624 . . . . 75.22 110.012 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 t -55.4 -40.68 58.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.371 0.532 . . . . 73.52 110.569 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.26 -45.72 69.03 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.623 0.769 . . . . 64.11 109.794 -176.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -58.49 -51.73 68.64 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.885 0.741 . . . . 73.23 109.462 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -69.57 -30.68 68.52 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.531 0.605 . . . . 72.33 111.407 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -67.13 -39.82 86.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.865 1.266 . . . . 74.33 111.266 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -43.71 78.25 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.493 -0.754 . . . . 63.52 110.083 171.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -76.96 46.49 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.497 1.919 . . . . 64.53 110.212 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.96 -174.77 3.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.923 2.089 . . . . 71.32 107.686 170.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -120.02 112.27 18.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.628 1.171 . . . . 65.13 108.565 176.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.0 mt -95.59 30.2 2.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.297 1.439 . . . . 73.41 110.295 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.95 -69.89 0.34 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.933 -1.136 . . . . 74.12 107.933 163.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -80.19 39.22 0.44 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.27 1.428 . . . . 73.42 113.083 -173.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -106.91 165.17 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.128 0.971 . . . . 55.01 108.83 170.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.68 -70.52 0.33 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.99 1.316 . . . . 74.44 108.9 170.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -56.99 75.8 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 128.993 2.917 . . . . 75.44 111.204 159.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -51.24 -32.04 22.89 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.262 -0.899 . . . . 74.12 111.644 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.8 p -65.47 -56.84 10.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 118.587 0.63 . . . . 64.55 109.977 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.67 -33.97 68.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.257 0.623 . . . . 73.11 111.436 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -60.82 -53.08 61.67 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.299 0.571 . . . . 72.23 109.945 176.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.1 tp -62.46 -42.45 99.47 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-O 121.445 0.641 . . . . 65.22 110.025 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.42 -37.75 68.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.79 1.636 . . . . 72.51 110.379 176.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.66 -57.4 17.91 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 124.966 1.27 . . . . 74.42 110.462 174.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.44 -47.86 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 117.804 0.802 . . . . 72.42 109.366 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.4 mtt -52.78 -46.74 67.74 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.985 0.914 . . . . 72.24 112.165 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -57.8 -49.92 75.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 118.796 0.725 . . . . 75.53 109.52 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -43.42 54.7 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.465 0.706 . . . . 75.51 111.647 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -71.8 -38.12 70.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.166 1.172 . . . . 72.31 114.166 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -73.66 -21.87 60.14 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.97 1.259 . . . . 74.44 111.786 172.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 . . . . . 0 N--CA 1.45 -0.442 0 C-N-CA 124.399 1.08 . . . . 61.34 108.609 -177.461 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 109.801 -1.32 . . . . 72.54 109.801 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t -129.34 -175.05 3.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.518 1.127 . . . . 70.1 110.453 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.19 -17.6 64.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 126.649 1.98 . . . . 74.31 113.924 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -67.95 -36.94 80.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.136 0.88 . . . . 65.2 109.09 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -46.51 -53.35 11.46 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 125.897 1.679 . . . . 62.24 112.577 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.45 -47.26 86.15 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.769 0.428 . . . . 45.2 111.552 -175.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.7 m -67.93 -35.59 78.69 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.042 -0.355 . . . . 74.12 110.042 -176.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.7 -34.96 60.43 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.38 -0.825 . . . . 73.34 112.067 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 17.3 mt -54.54 -36.23 64.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.32 0.648 . . . . 72.43 110.063 166.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -83.46 -21.07 32.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.669 0.788 . . . . 74.43 111.705 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 1.51 6.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.519 1.928 . . . . 73.43 112.236 174.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.47 0.79 46.9 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.683 1.135 . . . . 74.14 113.28 174.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.7 mt -84.94 144.72 42.19 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 118.241 1.02 . . . . 74.2 109.636 -169.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.91 156.04 56.62 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.922 1.748 . . . . 72.33 110.285 173.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -59.32 -45.7 90.59 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 124.951 1.3 . . . . 62.11 108.698 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -39.59 86.95 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.366 0.416 . . . . 74.33 111.098 -172.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.72 -58.78 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.681 1.592 . . . . 74.41 107.994 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.47 -44.99 46.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.448 1.099 . . . . 73.21 112.532 -174.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -58.6 -41.76 86.58 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.458 1.026 . . . . 53.12 111.467 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.61 -39.55 64.49 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.809 -0.557 . . . . 74.33 110.739 177.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.9 tp -69.76 -39.64 76.57 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.852 1.261 . . . . 74.41 110.811 -169.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -53.85 -47.1 71.32 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.952 1.301 . . . . 74.11 110.819 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.76 -24.78 58.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.77 1.628 . . . . 65.55 113.468 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -75.07 -25.09 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.128 -0.983 . . . . 72.25 109.183 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -89.43 -10.4 46.58 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.885 1.674 . . . . 72.35 112.706 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.8 t -84.79 -32.84 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 124.406 1.082 . . . . 74.52 111.975 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.73 13.86 16.97 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.91 0.777 . . . . 73.34 112.985 -168.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 61.55 31.44 77.68 Favored Glycine 0 CA--C 1.53 1.004 0 O-C-N 121.617 -0.677 . . . . 54.44 112.4 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.467 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 22.1 mt -83.54 -65.02 1.06 Allowed 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 126.799 2.04 . . . . 71.13 108.282 175.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.8 m -128.69 156.83 41.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 123.157 0.583 . . . . 74.41 109.894 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.48 154.65 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.267 0.627 . . . . 50.25 110.192 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.2 p80 -62.42 -15.1 47.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 118.729 -0.653 . . . . 73.25 112.547 175.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.8 p -120.22 22.25 11.45 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.217 1.807 . . . . 74.11 112.319 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -84.94 -3.49 58.76 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 123.265 1.507 . . . . 73.24 112.713 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -94.53 -172.86 2.87 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 126.334 1.854 . . . . 71.32 109.47 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -127.21 175.59 8.04 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.366 0.666 . . . . 74.42 111.584 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -63.69 -32.69 74.26 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.563 0.745 . . . . 75.23 111.282 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.1 mtp180 -61.83 -37.29 83.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.497 0.719 . . . . 75.31 109.947 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.17 93.94 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.651 0.78 . . . . 71.15 110.867 175.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.62 -50.92 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.954 0.797 . . . . 64.04 109.965 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -62.11 -51.25 68.67 Favored 'General case' 0 C--O 1.23 0.059 0 N-CA-C 109.875 -0.417 . . . . 71.22 109.875 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.47 69.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.164 -0.922 . . . . 74.41 112.299 -176.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.07 -51.73 67.91 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.955 0.798 . . . . 74.55 110.661 169.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.11 -39.99 83.97 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.003 0.82 . . . . 74.32 111.487 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -77.12 38.45 0.22 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-N 119.285 0.948 . . . . 74.54 112.473 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -129.1 146.75 50.97 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.335 -1.357 . . . . 72.33 107.335 161.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -68.49 170.3 9.31 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.826 0.346 . . . . 74.22 110.483 163.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -47.53 -64.17 0.86 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 127.38 2.272 . . . . 73.44 110.786 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -31.12 71.84 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 123.365 0.666 . . . . 74.43 110.871 -172.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.84 -53.95 10.56 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 110.319 -1.112 . . . . 72.51 110.319 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.5 -37.63 75.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.8 1.24 . . . . 70.24 111.599 177.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.98 -43.32 95.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 119.447 1.021 . . . . 65.55 110.937 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.74 -45.07 95.53 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.992 0.901 . . . . 61.42 110.785 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.23 -37.5 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.939 0.896 . . . . 51.22 110.315 176.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.03 -48.6 20.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 119.057 0.844 . . . . 70.53 110.994 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -57.5 -41.74 81.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.592 -0.892 . . . . 72.34 108.592 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -82.65 -10.07 59.1 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 112.866 0.691 . . . . 74.35 112.866 -176.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -67.18 -61.03 2.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.805 -0.813 . . . . 74.52 108.805 166.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.467 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -65.74 -39.73 91.39 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 118.697 -0.668 . . . . 70.44 110.453 -178.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -82.73 54.63 2.74 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.289 1.436 . . . . 64.41 110.145 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.97 -172.75 4.13 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.853 2.061 . . . . 74.24 107.999 173.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -129.51 114.69 16.42 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.212 1.405 . . . . 74.24 108.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.97 24.39 7.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.651 2.38 . . . . 70.32 110.8 -176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.6 t -70.5 -22.64 62.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.05 1.34 . . . . 62.32 112.512 -177.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -125.41 12.6 8.14 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.509 1.123 . . . . 73.35 112.301 -171.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.2 p -90.84 140.42 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.883 0.765 . . . . 74.14 109.314 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -36.2 23.09 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 122.287 -0.258 . . . . 72.15 111.183 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -137.9 118.56 14.01 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.424 1.49 . . . . 75.12 107.303 -163.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -64.4 -39.14 93.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.171 0.804 . . . . 74.54 113.171 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -40.33 94.41 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 124.884 1.274 . . . . 72.14 107.677 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.16 -19.3 65.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.857 0.753 . . . . 53.14 112.61 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -79.3 -51.24 9.7 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 122.15 0.976 . . . . 73.44 108.591 173.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.73 -47.27 86.31 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.203 -1.362 . . . . 74.22 108.408 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.6 p -59.91 -26.69 66.12 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.768 1.627 . . . . 72.24 110.411 -176.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.2 -53.05 5.36 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.154 -0.779 . . . . 74.35 111.154 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.9 t -57.23 -40.58 74.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 117.375 0.587 . . . . 71.24 110.031 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.0 mtt -55.48 -45.08 77.01 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 121.358 -0.839 . . . . 62.31 111.073 175.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -63.5 -54.75 31.43 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 108.908 -0.775 . . . . 74.22 108.908 -171.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.3 t -63.83 -36.81 85.13 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.889 -0.577 . . . . 74.42 110.543 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.26 -44.73 88.52 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 120.14 1.336 . . . . 74.33 113.36 174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.04 -11.51 59.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.253 0.479 . . . . 74.42 111.487 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 . . . . . 0 C--O 1.236 0.369 0 C-N-CA 125.244 1.418 . . . . 71.12 109.155 177.152 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.396 0 N-CA-C 111.442 -0.663 . . . . 65.51 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.43 -172.83 3.0 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.921 1.688 . . . . 74.33 110.579 -177.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -45.15 -44.15 10.47 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.483 2.313 . . . . 71.51 110.343 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.76 -39.14 80.11 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.461 1.104 . . . . 74.52 110.317 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -53.12 -57.96 8.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.269 1.027 . . . . 74.44 111.204 -175.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -65.04 -39.05 92.77 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.25 -0.58 . . . . 73.35 110.554 -175.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.6 m -65.8 -36.79 84.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.168 0.44 . . . . 73.42 110.122 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.13 -37.18 86.2 Favored 'General case' 0 C--N 1.34 0.179 0 O-C-N 120.816 -1.177 . . . . 70.45 111.105 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.52 -18.58 65.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 119.13 -0.462 . . . . 72.42 111.79 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.74 -14.16 21.0 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.778 0.831 . . . . 65.04 111.511 173.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.23 -0.34 14.1 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.033 1.733 . . . . 74.04 112.382 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.29 14.91 24.82 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.716 -1.047 . . . . 64.21 113.304 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.8 mt -113.12 152.44 45.03 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 118.927 1.364 . . . . 74.54 111.815 -166.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.3 160.41 48.89 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.005 2.47 . . . . 72.1 110.911 172.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -64.43 -46.0 85.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.252 -1.018 . . . . 64.52 108.252 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.79 -38.11 74.92 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.568 0.951 . . . . 75.12 113.568 -170.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.7 t -78.63 -43.05 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.605 -1.257 . . . . 74.4 107.605 178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.3 -32.32 56.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.968 0.804 . . . . 70.32 111.927 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.02 -23.25 65.27 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 114.367 1.247 . . . . 74.51 114.367 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.84 -6.14 20.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 118.947 0.794 . . . . 74.12 111.92 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 tt -104.66 -27.96 11.51 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 124.762 1.225 . . . . 74.55 111.59 -167.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.04 -41.86 88.86 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.314 0.961 . . . . 53.23 111.484 173.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.96 -24.24 51.61 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.232 1.413 . . . . 74.32 114.002 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -73.25 -18.12 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.801 0.841 . . . . 73.25 109.436 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -99.79 -27.77 13.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.445 1.498 . . . . 74.11 112.651 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.3 t -58.87 -51.06 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-O 118.996 -0.526 . . . . 71.55 110.496 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.08 0.88 46.61 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.93 1.085 . . . . 74.34 113.93 -162.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 44.34 87.96 Favored Glycine 0 CA--C 1.529 0.92 0 O-C-N 121.245 -0.909 . . . . 72.53 112.016 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.429 HD11 ' HE3' ' A' ' 59' ' ' LYS . 1.4 mt -82.09 -74.59 0.34 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 126.552 1.941 . . . . 74.24 107.035 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 m -103.34 146.84 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 N-CA-C 113.83 1.048 . . . . 65.44 113.83 172.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.17 26.89 0.06 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 129.003 2.921 . . . . 74.14 116.46 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . 0.303 2.9 p80 55.46 -21.24 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.828 2.851 . . . . 70.34 116.75 -165.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.1 p -129.14 16.55 6.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.447 1.476 . . . . 71.13 112.118 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.73 -15.41 58.46 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.299 1.44 . . . . 70.12 113.709 -173.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.14 170.41 10.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.619 1.568 . . . . 74.05 111.601 -160.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -105.45 158.51 16.61 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.831 -0.803 . . . . 64.12 108.831 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -47.59 -46.86 28.67 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.769 2.028 . . . . 64.41 110.45 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -59.16 -35.19 73.09 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 122.987 0.515 . . . . 72.41 111.973 -176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.88 62.38 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.442 -0.79 . . . . 73.02 110.291 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 6.9 mm -71.79 -41.12 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 74.15 110.135 175.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.64 -58.59 6.46 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.867 -0.79 . . . . 73.1 108.867 175.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.85 -40.2 63.19 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.245 1.018 . . . . 70.32 111.471 -174.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.2 mt -46.99 -54.09 10.94 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 124.424 1.09 . . . . 73.43 111.541 173.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -28.6 69.22 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.462 0.574 . . . . 72.22 111.773 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -73.25 -16.22 61.4 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.479 -0.763 . . . . 65.03 112.441 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -85.93 137.44 32.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.567 1.147 . . . . 74.53 110.937 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.36 166.01 3.28 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 113.341 -1.754 . . . . 72.32 110.677 156.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.14 -58.16 9.12 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 113.946 -1.479 . . . . 72.22 110.553 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.03 -30.95 70.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.874 0.369 . . . . 75.52 111.406 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.26 -66.98 2.44 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 108.564 -1.814 . . . . 70.22 108.564 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.5 -42.0 70.26 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.986 0.735 . . . . 64.23 112.986 -177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.14 -41.61 88.72 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.763 0.825 . . . . 72.54 111.405 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.1 -42.51 62.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.361 0.264 . . . . 63.42 110.812 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 70.0 t -54.28 -29.85 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.442 1.497 . . . . 71.21 110.27 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.7 mt -77.48 -54.52 6.32 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.36 1.064 . . . . 74.31 109.013 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -56.76 -51.09 70.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 123.634 0.584 . . . . 72.43 109.869 -175.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -72.29 -7.5 49.8 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.267 0.84 . . . . 74.33 113.267 -172.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -93.64 -58.41 2.28 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 125.833 1.653 . . . . 74.25 110.216 174.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.429 ' HE3' HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -58.05 -33.37 68.93 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.591 1.156 . . . . 73.11 110.885 178.159 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -76.77 52.33 0.83 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.247 1.819 . . . . 61.55 109.977 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m -154.73 171.56 19.35 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 120.23 -1.544 . . . . 71.11 109.814 168.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -110.68 96.98 6.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.084 1.354 . . . . 64.45 107.673 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.5 mt -89.65 -6.25 56.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 118.1 -0.952 . . . . 72.23 112.782 -164.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.84 -56.06 5.85 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 73.31 111.722 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -101.2 9.93 41.35 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.42 0.688 . . . . 74.32 112.415 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.6 t -73.5 104.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 106.803 -1.555 . . . . 72.43 106.803 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -62.67 -28.04 69.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.326 1.05 . . . . 72.41 113.251 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -129.15 96.15 4.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.996 0.918 . . . . 73.12 108.639 177.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -54.27 -33.83 59.48 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.218 1.007 . . . . 73.43 109.999 172.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 m -69.66 -51.04 38.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.789 1.635 . . . . 74.25 111.39 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.18 74.45 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.15 0.432 . . . . 74.22 110.393 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -64.73 -51.8 60.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.02 -0.733 . . . . 72.23 109.02 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.3 tp -67.62 -58.09 5.3 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.628 1.171 . . . . 73.42 110.205 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -22.54 66.94 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.601 -0.727 . . . . 74.12 110.983 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.42 -48.44 14.03 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.193 -0.782 . . . . 54.31 111.35 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.0 t -55.31 -45.19 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 118.453 1.126 . . . . 74.15 109.678 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.1 mtt -50.78 -51.41 50.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.471 0.578 . . . . 74.21 111.147 171.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -49.09 73.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.826 -0.607 . . . . 73.23 110.357 -174.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -46.47 89.46 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.379 0.536 . . . . 70.12 110.8 175.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -54.28 -52.63 60.82 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.76 0.709 . . . . 73.52 111.84 -175.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -67.92 -9.33 44.26 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.132 0.573 . . . . 71.14 111.493 -177.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 . . . . . 0 N--CA 1.45 -0.427 0 C-N-CA 126.379 1.872 . . . . 74.21 110.573 -179.261 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.484 0 N-CA-C 109.563 -1.415 . . . . 43.44 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 t -101.83 -178.39 3.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.461 0.648 . . . . 71.54 110.734 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.91 -24.35 66.9 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.499 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.44 -40.84 83.66 Favored 'General case' 0 C--N 1.346 0.423 0 N-CA-C 109.022 -0.733 . . . . 71.25 109.022 -176.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -45.16 -53.44 8.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.853 1.261 . . . . 73.42 112.545 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -65.47 -41.6 93.16 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.224 -0.417 . . . . 72.43 111.602 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -65.66 -31.43 72.44 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.475 0.71 . . . . 71.32 110.769 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.53 -40.55 76.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.884 -1.135 . . . . 70.45 110.268 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.14 -23.47 66.59 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.984 0.811 . . . . 73.32 111.579 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.82 -18.87 38.95 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.508 0.594 . . . . 54.35 111.647 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.38 -0.46 29.16 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.972 -1.08 . . . . 72.4 112.754 -161.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 7.09 45.67 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.429 1.014 . . . . 64.41 111.964 -171.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.0 144.92 28.66 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 118.504 1.152 . . . . 74.13 110.04 -172.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.72 163.21 38.02 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.117 1.878 . . . . 62.23 110.228 167.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -57.7 -48.12 80.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.312 -0.996 . . . . 73.44 108.312 177.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.46 -31.45 70.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 112.896 0.702 . . . . 75.21 112.896 -169.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.15 -51.5 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.288 1.435 . . . . 71.5 108.591 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -38.65 71.84 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.427 0.691 . . . . 73.53 111.98 -177.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.0 -48.1 52.64 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.804 1.642 . . . . 75.31 110.966 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.29 31.58 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 124.563 1.145 . . . . 75.13 110.465 -175.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.37 -42.83 87.44 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 119.419 1.008 . . . . 62.1 111.376 177.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -51.02 -41.52 59.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.337 1.055 . . . . 64.52 111.328 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -53.29 -36.62 61.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 127.594 2.358 . . . . 75.2 112.712 177.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.4 mt -74.5 -14.07 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.093 0.957 . . . . 65.42 108.64 -174.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -100.58 -8.95 22.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.792 1.637 . . . . 74.51 112.086 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 84.5 t -78.55 -34.5 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 125.496 1.518 . . . . 74.3 111.265 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 -3.89 58.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.235 1.198 . . . . 73.33 114.235 -161.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 63.97 28.9 73.45 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 121.363 -0.836 . . . . 74.44 111.46 -163.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 mt -71.36 -81.94 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 128.253 2.621 . . . . 74.51 105.783 162.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.0 m -124.71 176.79 5.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 123.724 0.81 . . . . 71.12 111.48 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.37 155.25 20.21 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 125.184 1.393 . . . . 74.34 108.044 166.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -48.77 -32.32 8.41 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.605 1.562 . . . . 72.13 112.343 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.07 5.88 31.55 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.998 2.119 . . . . 71.1 113.47 -175.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.82 -15.21 63.44 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 119.276 -2.14 . . . . 73.53 114.522 -177.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.6 mt -95.89 136.94 35.66 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.753 0.821 . . . . 74.33 111.729 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.79 155.33 40.92 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.136 -1.431 . . . . 73.42 107.136 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.12 -32.6 71.16 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.787 -0.57 . . . . 74.11 110.961 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -61.89 -29.63 70.33 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.684 0.794 . . . . 73.14 112.773 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.97 -35.87 31.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.644 -0.502 . . . . 73.34 109.644 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mm -60.86 -43.26 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.657 0.662 . . . . 73.4 109.28 172.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.24 -55.85 24.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.431 1.092 . . . . 73.31 110.244 171.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.97 -37.76 74.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 119.224 -0.417 . . . . 73.12 111.743 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -42.28 78.81 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.479 0.712 . . . . 74.24 111.596 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -25.89 67.08 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.627 0.648 . . . . 74.51 112.585 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -75.87 -13.28 60.27 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 120.007 1.276 . . . . 72.4 113.118 -173.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -90.69 135.53 33.65 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.514 1.526 . . . . 73.32 108.714 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -65.97 170.01 6.06 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.278 -0.873 . . . . 71.44 110.595 163.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -46.78 -64.39 0.78 Allowed 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 126.997 2.119 . . . . 73.42 111.52 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -64.15 -36.69 84.85 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.009 0.524 . . . . 74.23 111.817 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -64.87 -46.36 89.72 Favored Glycine 0 C--N 1.34 0.797 0 N-CA-C 110.617 -0.993 . . . . 71.41 110.617 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.56 82.01 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.932 1.693 . . . . 73.51 110.395 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.19 -45.63 75.81 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.713 0.688 . . . . 75.43 110.362 177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.15 82.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.74 0.274 . . . . 73.53 111.74 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.9 t -56.64 -41.94 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.29 1.036 . . . . 74.5 110.564 175.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.15 -43.29 78.61 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.668 -0.645 . . . . 74.41 110.213 -174.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -62.93 -39.81 95.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.384 -0.969 . . . . 71.23 108.384 -176.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -74.19 -31.14 62.54 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 118.273 0.488 . . . . 75.4 111.231 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.71 -57.99 10.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.916 0.486 . . . . 74.41 109.892 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -21.97 66.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.336 -0.84 . . . . 74.43 112.105 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -74.99 49.01 0.41 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.42 1.009 . . . . 72.5 109.564 164.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.7 m -152.52 150.05 29.17 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.362 1.465 . . . . 71.43 111.566 172.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -97.58 87.21 4.02 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 122.946 1.355 . . . . 71.3 109.617 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 mt -76.76 46.33 0.45 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.619 1.968 . . . . 73.11 111.378 -172.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.8 m -95.04 -5.46 44.38 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.526 1.531 . . . . 71.13 112.607 167.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -125.72 41.2 3.57 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.498 -1.376 . . . . 70.11 111.463 -175.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.69 100.58 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 124.899 1.279 . . . . 74.33 109.959 -168.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.573 ' H ' ' NE2' ' A' ' 67' ' ' GLN . 1.3 pm0 -65.69 -47.07 76.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.32 1.048 . . . . 74.13 112.599 176.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -107.43 99.03 8.57 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 106.589 -1.634 . . . . 70.3 106.589 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -60.35 -34.72 74.24 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.079 0.466 . . . . 74.42 109.964 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 72.5 p -64.71 -55.53 19.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.634 1.174 . . . . 65.5 110.659 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.88 -26.73 67.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 119.081 -0.485 . . . . 73.24 112.028 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -63.31 -54.34 38.55 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.696 0.68 . . . . 72.23 109.866 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.72 -52.88 63.8 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.967 0.907 . . . . 74.4 109.613 -178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.11 -29.29 65.38 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 115.749 -0.66 . . . . 74.13 112.194 176.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.61 -39.15 90.71 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.708 1.147 . . . . 71.52 112.263 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 94.9 t -64.67 -48.52 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 107.67 -1.233 . . . . 74.43 107.67 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtp -58.52 -33.14 69.52 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.011 -1.056 . . . . 71.4 112.297 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -58.05 -58.15 9.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.84 -0.8 . . . . 74.41 108.84 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.9 t -62.49 -50.1 72.73 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.934 -0.555 . . . . 74.12 110.157 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -49.14 -28.66 4.51 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 117.475 2.398 . . . . 74.12 117.475 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -115.28 0.24 13.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.337 0.971 . . . . 74.5 112.659 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 126.738 2.015 . . . . 74.34 108.799 159.456 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.775 0 N-CA-C 110.569 -1.013 . . . . 62.32 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -127.16 -165.37 1.46 Allowed 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.985 0.914 . . . . 74.53 110.755 -173.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -55.07 -28.95 56.26 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 113.921 1.082 . . . . 73.55 113.921 -166.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -34.65 78.54 Favored 'General case' 0 N--CA 1.461 0.103 0 C-N-CA 123.525 0.73 . . . . 71.43 110.447 -177.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -54.79 -47.53 73.85 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.491 1.116 . . . . 74.32 110.348 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -62.26 -49.48 75.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.947 -0.549 . . . . 73.24 110.378 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -55.08 -49.55 71.4 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.425 1.09 . . . . 70.45 109.703 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.4 mt -65.8 -39.2 90.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 O-C-N 121.67 -0.644 . . . . 72.15 111.257 -177.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -64.13 -15.13 59.09 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 118.768 -0.634 . . . . 74.51 111.522 175.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.77 2.35 27.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.895 1.678 . . . . 74.23 112.711 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -96.95 24.3 6.35 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.039 1.336 . . . . 71.34 111.861 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.95 16.9 78.29 Favored Glycine 0 CA--C 1.525 0.692 0 O-C-N 121.18 -0.95 . . . . 72.35 112.979 -177.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -111.02 156.82 40.26 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 118.65 1.225 . . . . 72.51 111.371 -173.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.82 173.92 13.69 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.259 3.306 . . . . 63.44 113.917 175.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -76.68 -46.01 27.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 126.377 1.871 . . . . 73.55 111.055 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -57.37 -42.08 81.41 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 118.948 0.794 . . . . 74.01 111.34 -176.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.3 t -58.49 -63.28 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 125.017 1.327 . . . . 72.11 108.107 168.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.21 -47.27 24.44 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.161 1.385 . . . . 72.21 112.012 -171.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -53.01 -56.9 12.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.624 1.569 . . . . 74.12 110.828 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -67.4 -38.65 85.01 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.907 -0.405 . . . . 70.33 109.907 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.22 -42.65 65.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.206 1.402 . . . . 72.55 110.976 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -49.82 -50.52 44.83 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.017 1.727 . . . . 73.55 110.461 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.17 -16.3 52.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.947 1.699 . . . . 73.35 113.617 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.2 mt -73.75 -31.38 31.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 120.994 -1.066 . . . . 70.2 108.707 175.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -85.39 -48.38 9.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.882 0.873 . . . . 74.55 110.228 -177.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -53.83 -39.53 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.58 0.752 . . . . 73.23 111.758 -175.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.75 0.31 7.35 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.129 0.971 . . . . 73.22 112.888 -175.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.83 7.01 71.63 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 125.327 1.442 . . . . 63.3 112.793 174.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.458 HD13 ' HE2' ' A' ' 59' ' ' LYS . 39.8 mt -75.91 -59.8 2.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.13 0.965 . . . . 74.13 109.704 -166.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.7 167.25 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.24 1.016 . . . . 70.22 112.248 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.2 155.26 27.47 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.774 0.829 . . . . 74.51 109.779 171.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -73.8 -38.18 64.7 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.949 -0.469 . . . . 72.31 110.661 175.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.33 7.72 9.0 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.72 0.691 . . . . 72.22 112.395 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.02 -4.36 40.84 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.991 1.108 . . . . 73.13 113.991 -166.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.46 169.44 8.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.727 1.211 . . . . 73.41 110.325 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -108.36 172.11 7.02 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.27 1.428 . . . . 74.34 109.836 -173.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.1 -44.64 64.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.037 1.335 . . . . 74.41 111.344 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -57.56 -22.84 47.12 Favored 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 125.795 1.638 . . . . 73.4 113.673 175.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.2 -36.38 34.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.939 -1.029 . . . . 74.33 110.283 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.8 mm -63.41 -59.75 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 108.218 -1.031 . . . . 74.14 108.218 172.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -58.98 -47.55 84.75 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.231 1.012 . . . . 72.22 111.189 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -30.14 66.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 118.012 -0.994 . . . . 72.43 111.712 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.3 -38.35 65.82 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-N 119.728 1.149 . . . . 65.5 111.204 170.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -64.01 -26.42 68.56 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.777 0.717 . . . . 74.54 111.525 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -74.88 -18.04 60.49 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.685 -0.634 . . . . 74.43 112.051 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -88.52 140.5 29.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.203 1.001 . . . . 74.55 109.521 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -69.23 176.22 3.42 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.27 -1.332 . . . . 72.34 109.367 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -54.76 -59.28 4.93 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.22 -1.354 . . . . 74.25 111.673 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.56 -27.89 45.91 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 119.64 -0.219 . . . . 72.33 110.972 -170.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.17 -48.96 79.29 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.424 -1.47 . . . . 74.11 109.424 171.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.84 -43.99 94.33 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.807 0.803 . . . . 72.13 110.576 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.91 -36.29 83.47 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.5 -0.75 . . . . 63.15 112.012 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -43.85 82.56 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.029 0.831 . . . . 72.1 110.517 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 65.5 t -55.07 -42.09 62.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 123.255 0.622 . . . . 64.51 109.729 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.42 -38.06 56.14 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 121.77 -0.581 . . . . 71.11 111.653 -175.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.45 -28.85 68.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.727 -0.654 . . . . 62.43 110.617 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -75.42 -36.28 60.82 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.925 0.784 . . . . 73.43 110.48 171.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -56.48 -57.74 11.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.976 0.91 . . . . 74.2 111.63 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.458 ' HE2' HD13 ' A' ' 29' ' ' LEU . 34.0 ttmt -63.54 -30.15 71.31 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.548 0.613 . . . . 73.41 111.46 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -73.83 10.23 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.323 1.449 . . . . 74.03 113.117 -172.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.2 m -112.57 165.98 11.75 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.486 1.514 . . . . 61.32 111.666 -173.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -95.99 105.54 17.59 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 107.713 -1.218 . . . . 71.33 107.713 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.471 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 91.8 mt -92.22 -7.28 48.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.698 -0.683 . . . . 72.14 112.823 -171.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 m -60.29 -27.01 66.95 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.433 1.642 . . . . 74.21 115.433 -169.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -131.72 16.11 4.82 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.344 1.057 . . . . 72.21 111.439 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -64.04 154.28 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.573 1.149 . . . . 73.54 109.966 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -63.64 1.24 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.374 -0.376 . . . . 74.4 110.355 -178.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -127.1 134.76 50.18 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 106.638 -1.616 . . . . 71.24 106.638 166.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HE3' ' HB3' ' A' ' 63' ' ' LEU . 29.8 mmtm -59.57 -27.4 66.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.084 0.865 . . . . 70.51 111.051 172.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.7 p -72.66 -53.08 12.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.473 0.709 . . . . 70.44 110.398 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.96 -38.91 65.47 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.8 0.44 . . . . 71.53 111.425 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -60.05 -51.78 68.17 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.732 0.777 . . . . 65.41 109.531 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.9 tp -62.17 -52.07 65.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.705 -0.85 . . . . 73.32 108.705 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 11.9 t -57.65 -28.22 63.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.03 0.932 . . . . 62.24 111.448 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.43 -49.6 50.21 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 111.16 -0.776 . . . . 61.51 111.16 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.94 -37.85 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 117.826 0.813 . . . . 74.13 111.254 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.2 mtt -55.21 -44.83 75.76 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.0 -1.063 . . . . 73.13 111.09 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -58.5 -50.68 72.86 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.01 0.924 . . . . 73.41 110.723 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 t -68.63 -36.35 78.51 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.605 -1.188 . . . . 74.34 111.112 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -65.23 -31.11 72.1 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 122.245 2.293 . . . . 65.31 112.798 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 mmm-85 -69.52 -28.19 65.82 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 121.173 -0.954 . . . . 73.5 111.279 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 . . . . . 0 C--O 1.241 0.65 0 C-N-CA 125.857 1.663 . . . . 64.14 110.471 -176.846 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.552 0 N-CA-C 110.564 -1.014 . . . . 75.35 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.55 -179.97 7.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.675 1.226 . . . . 75.22 110.476 174.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -28.97 67.13 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 114.733 -1.121 . . . . 74.42 112.219 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -52.71 -31.35 37.22 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.865 1.266 . . . . 73.13 112.86 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.4 -42.82 74.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.264 0.626 . . . . 74.25 110.948 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -64.27 -46.44 83.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.279 1.031 . . . . 73.34 111.999 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -70.24 -30.36 67.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.022 0.828 . . . . 70.25 110.365 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.58 -47.87 79.73 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 120.86 -1.15 . . . . 74.41 109.505 172.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.0 mt -65.25 -15.04 62.06 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.928 0.891 . . . . 73.32 113.175 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' ' 12' ' ' GLY . 9.3 t0 -87.88 -42.14 12.72 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.501 1.92 . . . . 64.44 110.431 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.16 15.81 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.684 2.794 . . . . 74.21 112.902 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 10' ' ' ASP . . . 77.35 12.33 84.66 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 127.174 2.321 . . . . 54.21 112.641 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.8 mt -85.71 145.98 42.84 Favored Pre-proline 0 C--O 1.237 0.417 0 CA-C-N 118.424 1.112 . . . . 74.23 108.908 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -71.02 167.75 25.18 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.578 2.186 . . . . 53.45 112.478 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -70.84 -48.07 55.93 Favored 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 124.974 1.309 . . . . 70.33 110.053 -174.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -62.45 -40.15 95.67 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 119.457 -0.897 . . . . 72.51 111.107 -172.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 76.6 t -60.53 -57.07 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.178 -1.045 . . . . 72.15 108.178 172.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.72 -42.1 62.02 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.411 1.085 . . . . 74.45 113.55 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.12 -52.34 64.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.96 0.904 . . . . 73.51 110.566 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -28.58 62.34 Favored 'General case' 0 N--CA 1.461 0.085 0 O-C-N 121.694 -0.629 . . . . 74.24 110.144 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.23 -35.24 77.65 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.731 0.696 . . . . 74.23 111.28 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -53.03 -43.43 66.57 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.731 1.213 . . . . 73.31 111.57 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -64.57 -15.34 60.89 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 125.633 1.573 . . . . 72.55 113.883 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -76.5 -42.52 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.921 -1.14 . . . . 75.42 107.921 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -84.39 -10.47 57.53 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 113.586 0.958 . . . . 75.45 113.586 -172.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.4 t -86.59 -19.92 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 119.081 0.855 . . . . 72.34 110.576 170.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.64 7.26 30.71 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.272 -0.893 . . . . 72.25 113.371 -165.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.19 5.55 48.95 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.31 -0.869 . . . . 71.04 113.848 -175.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -77.1 -61.08 2.1 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.805 1.302 . . . . 75.33 109.15 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.14 -174.25 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 123.664 0.785 . . . . 74.42 110.634 176.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -124.65 154.96 39.96 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.499 2.32 . . . . 73.41 107.585 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -57.91 -19.47 30.04 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.699 1.0 . . . . 72.35 113.699 -174.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -104.41 15.35 28.38 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.832 -1.167 . . . . 64.43 111.871 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -67.41 -18.48 65.13 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.92 -1.737 . . . . 74.25 114.228 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 85.2 mt -90.58 167.81 12.27 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.703 0.801 . . . . 75.32 111.59 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.97 156.84 17.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.629 -1.619 . . . . 60.35 106.629 171.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -64.35 -30.02 71.08 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.564 -0.71 . . . . 72.25 110.27 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -55.12 -22.48 16.83 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.446 1.098 . . . . 71.21 113.611 170.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -92.94 -44.52 8.4 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.004 1.322 . . . . 73.35 110.925 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.25 -42.53 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 119.146 0.885 . . . . 75.44 109.36 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -51.09 -49.3 60.96 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.498 1.119 . . . . 74.22 111.135 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.8 92.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.903 0.481 . . . . 74.24 110.092 -172.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 mt -58.44 -34.19 70.55 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.598 0.592 . . . . 73.12 112.598 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -60.54 -26.99 67.3 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 119.126 -0.464 . . . . 73.02 111.54 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -80.13 -18.19 50.5 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.81 1.041 . . . . 72.21 113.81 -168.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -87.12 155.41 20.13 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.008 1.323 . . . . 73.43 110.006 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -79.56 -177.66 5.93 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.273 1.429 . . . . 74.11 110.397 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -52.14 -70.86 0.08 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.109 1.764 . . . . 73.54 110.492 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -60.92 -45.59 94.05 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 124.886 1.275 . . . . 75.45 109.994 -174.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.78 -54.7 33.22 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 110.207 -1.157 . . . . 52.01 110.207 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.57 76.32 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.882 0.841 . . . . 65.45 110.672 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.61 -41.54 66.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.207 1.003 . . . . 75.41 110.815 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.98 79.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.882 0.31 . . . . 74.13 110.505 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.0 t -58.97 -34.99 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 124.474 1.109 . . . . 75.22 110.471 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.9 -43.24 83.91 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.498 0.719 . . . . 75.21 109.985 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -43.97 92.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.122 -1.436 . . . . 72.23 107.122 -177.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -76.3 -33.71 59.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.488 -0.56 . . . . 74.12 109.488 -168.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -60.15 -62.7 1.68 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.471 1.108 . . . . 75.15 110.785 171.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -44.54 62.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.967 1.707 . . . . 74.43 111.701 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.22 15.05 0.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.852 1.261 . . . . 74.21 113.47 -173.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.7 m -112.53 173.68 6.26 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.478 1.511 . . . . 62.32 111.383 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -103.41 123.94 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.498 -1.667 . . . . 71.23 106.498 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.8 mt -105.68 -9.55 17.26 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 125.256 1.423 . . . . 75.53 112.242 -171.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.5 m -56.68 -26.81 57.43 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.717 2.007 . . . . 75.32 114.637 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -122.91 11.57 9.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.573 1.149 . . . . 75.53 110.924 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.7 t -71.38 127.83 33.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 O-C-N 120.891 -1.13 . . . . 75.55 108.205 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -64.29 -56.73 12.51 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.136 1.775 . . . . 73.13 110.379 -175.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -128.77 126.01 39.05 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 105.291 -2.114 . . . . 75.33 105.291 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -60.96 -27.78 68.5 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.558 0.536 . . . . 73.43 111.629 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.4 p -73.77 -54.05 8.92 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.127 2.171 . . . . 73.43 110.81 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.01 64.69 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 118.356 0.525 . . . . 71.32 111.984 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -67.21 -46.5 73.68 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 120.603 0.24 . . . . 74.55 110.535 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -62.54 -42.88 99.81 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.811 0.444 . . . . 73.35 110.171 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.64 -28.4 63.67 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.14 -0.933 . . . . 75.34 112.557 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.6 -55.98 6.33 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.356 0.979 . . . . 40.03 111.907 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 22.4 t -62.05 -39.97 85.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 118.023 0.911 . . . . 71.53 109.863 -173.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 28.7 mtm -57.21 -42.1 80.7 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.483 -1.385 . . . . 62.33 111.491 172.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -61.76 -38.86 89.58 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 121.79 -0.569 . . . . 74.12 110.654 -177.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -50.89 61.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.371 -0.823 . . . . 72.24 110.515 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -54.22 -32.68 56.46 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.557 0.947 . . . . 73.55 113.557 177.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -13.53 61.24 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 114.227 1.195 . . . . 74.15 114.227 175.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.237 0.419 0 C-N-CA 125.053 1.341 . . . . 73.11 108.497 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.698 0 N-CA-C 110.287 -1.125 . . . . 61.02 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -119.43 178.9 4.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.555 0.742 . . . . 61.31 110.845 177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -31.98 46.18 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.726 1.211 . . . . 75.42 113.769 -176.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -57.85 -33.9 69.15 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.358 1.063 . . . . 63.34 111.739 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -52.84 -56.72 13.74 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.298 1.039 . . . . 75.41 111.657 -172.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -57.93 -32.33 67.68 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.636 0.775 . . . . 75.1 111.536 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.0 m -67.18 -33.64 75.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 117.917 -1.039 . . . . 73.21 110.907 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -39.81 94.64 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.698 2.044 . . . . 73.24 110.189 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -66.51 -16.56 64.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.502 0.721 . . . . 74.24 112.076 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -93.51 -39.4 10.89 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.498 1.919 . . . . 73.22 109.728 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.413 ' O ' ' HE2' ' A' ' 44' ' ' LYS . . . -70.35 8.0 0.9 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 129.805 3.242 . . . . 72.13 112.913 -174.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 109.47 -0.37 30.9 Favored Glycine 0 N--CA 1.439 -1.158 0 C-N-CA 124.979 1.276 . . . . 73.13 113.577 172.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -105.3 154.76 38.71 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 119.275 1.537 . . . . 75.33 112.329 -162.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -78.63 172.76 14.65 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.066 2.51 . . . . 73.11 111.789 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.24 -42.46 59.67 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 118.219 -0.896 . . . . 74.01 110.712 -174.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -64.72 -41.62 95.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 118.732 -1.187 . . . . 64.44 110.565 -167.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.9 t -58.07 -56.46 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 125.59 1.556 . . . . 75.12 108.739 168.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -37.16 67.85 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.037 0.754 . . . . 63.04 113.037 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.421 ' C ' ' HE3' ' A' ' 20' ' ' LYS . 3.8 mt-10 -63.33 -20.66 65.7 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.264 1.026 . . . . 74.34 112.744 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.421 ' HE3' ' C ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -98.25 -32.48 11.54 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.23 0.923 . . . . 74.24 110.46 170.127 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -31.67 71.38 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 125.116 1.366 . . . . 74.02 111.129 -175.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -54.52 -51.17 65.98 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 126.193 1.797 . . . . 72.04 112.033 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.91 -34.52 28.76 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.672 2.389 . . . . 73.15 112.503 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.9 mt -63.42 -28.17 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 108.447 -0.946 . . . . 75.32 108.447 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.42 13.11 32.52 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.804 1.642 . . . . 75.45 112.805 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -111.06 -36.18 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.306 1.042 . . . . 73.21 109.912 173.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.93 9.62 3.45 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.009 -1.057 . . . . 74.15 112.981 -174.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.03 11.46 66.89 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 118.999 -0.889 . . . . 72.12 113.147 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.408 HD12 ' HE2' ' A' ' 59' ' ' LYS . 88.6 mt -66.12 -65.85 0.62 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.522 1.161 . . . . 70.03 108.121 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.3 m -135.45 164.02 34.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 O-C-N 123.238 0.336 . . . . 75.44 111.213 -173.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -90.15 155.2 19.2 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.208 1.003 . . . . 75.41 110.269 175.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -63.01 -23.81 67.63 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.259 -0.901 . . . . 63.34 112.209 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -100.5 12.88 36.32 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.76 1.022 . . . . 73.32 113.76 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.22 -26.35 62.0 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.601 -1.312 . . . . 75.44 112.579 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.9 mt -76.51 156.57 32.84 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.381 0.672 . . . . 74.21 110.835 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -110.25 173.59 6.26 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.834 1.653 . . . . 73.03 108.996 171.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -35.76 75.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 75.31 111.322 -164.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -66.02 -20.43 66.18 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 118.504 -0.76 . . . . 75.31 111.975 -176.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.64 18.52 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.309 0.959 . . . . 72.44 110.797 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.3 mm -67.09 -38.94 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 108.344 -0.984 . . . . 72.04 108.344 174.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -61.59 -45.56 93.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.481 -0.762 . . . . 74.43 110.473 172.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.13 -42.85 95.68 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.273 -0.394 . . . . 75.24 111.48 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.82 -49.08 74.23 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.978 0.911 . . . . 74.41 111.447 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -53.23 -19.53 3.21 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.818 1.647 . . . . 73.14 113.931 178.921 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.57 -20.36 26.55 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 120.168 1.349 . . . . 75.31 114.224 -170.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -90.0 152.38 21.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.141 0.976 . . . . 74.03 111.127 -165.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -74.03 -175.51 2.22 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.486 -1.234 . . . . 74.01 110.337 164.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -53.37 -68.0 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 124.71 1.204 . . . . 75.03 112.089 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -72.04 -35.3 69.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.086 -0.709 . . . . 73.41 109.086 -173.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.99 -46.12 70.02 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 110.93 -0.868 . . . . 75.12 110.93 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.17 -51.53 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 118.365 -0.826 . . . . 75.33 109.686 177.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.07 -43.45 70.29 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.01 0.924 . . . . 74.41 111.478 -178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.406 1.082 . . . . 70.01 111.027 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 89.6 t -57.69 -44.31 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 109.434 -0.58 . . . . 74.33 109.434 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -69.14 -49.12 59.84 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 123.487 0.715 . . . . 72.32 109.285 -173.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -51.35 -60.41 3.15 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 127.154 2.181 . . . . 70.25 108.298 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -63.86 -35.48 80.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.188 0.518 . . . . 74.01 110.649 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -66.53 -55.78 13.92 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.856 0.862 . . . . 71.34 110.891 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.408 ' HE2' HD12 ' A' ' 29' ' ' LEU . 2.0 ttmm -64.29 -29.71 70.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.777 0.831 . . . . 71.25 111.997 177.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -76.55 33.81 0.14 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.694 1.997 . . . . 65.53 111.299 172.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -140.93 171.57 13.89 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.645 2.378 . . . . 64.34 109.768 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -119.83 121.12 38.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.743 2.017 . . . . 73.33 106.696 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 22.1 mt -112.72 7.77 18.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.816 1.647 . . . . 75.12 112.213 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.4 t -58.67 -30.93 67.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.674 1.59 . . . . 71.01 111.724 -173.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -120.39 41.92 3.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 124.296 1.038 . . . . 75.42 109.424 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.6 t -129.74 111.05 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 124.37 1.068 . . . . 74.01 108.477 171.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -57.34 -64.28 0.94 Allowed 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.52 0.728 . . . . 75.44 109.571 171.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -81.25 89.36 6.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.831 0.824 . . . . 74.24 109.988 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -61.74 -37.01 82.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.615 -0.72 . . . . 75.13 111.112 178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 p -61.94 -56.28 20.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 124.656 1.182 . . . . 73.44 108.715 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.473 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . . . -63.01 -20.7 65.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.023 1.12 . . . . 61.32 114.023 -174.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -73.98 -56.37 5.03 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.641 -0.874 . . . . 71.12 108.641 174.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.68 -48.51 81.48 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 125.077 1.351 . . . . 72.05 109.36 -172.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 71' ' ' ALA . 1.7 p -59.16 -30.58 68.27 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.198 -1.365 . . . . 72.24 109.443 -175.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.2 -45.36 71.34 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 125.039 1.304 . . . . 61.12 111.818 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.3 t -57.5 -40.79 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 118.964 1.382 . . . . 71.41 109.544 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.4 mtt -62.72 -36.18 82.16 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.828 -1.17 . . . . 74.22 110.931 175.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.0 tttp -62.69 -56.89 13.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.033 -0.729 . . . . 63.23 109.033 -176.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.94 -51.48 61.26 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.244 -0.884 . . . . 71.21 108.98 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.47 -33.84 73.17 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 115.355 1.613 . . . . 75.13 115.355 -173.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.12 -10.22 59.75 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.539 0.609 . . . . 75.05 111.22 177.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 . . . . . 0 N--CA 1.447 -0.597 0 C-N-CA 126.947 2.099 . . . . 63.44 109.333 -175.452 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.665 0 N-CA-C 111.439 -0.664 . . . . 75.5 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.35 179.38 7.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 122.562 1.172 . . . . 72.12 109.891 168.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -52.35 -31.8 35.29 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.612 2.365 . . . . 75.1 113.776 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -66.11 -34.73 78.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.12 0.568 . . . . 64.31 109.87 -172.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -45.12 -54.12 7.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.879 1.671 . . . . 73.15 111.998 -176.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -70.27 -39.69 74.79 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 112.199 0.444 . . . . 73.23 112.199 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.8 m -66.43 -34.42 77.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.115 0.566 . . . . 75.42 110.389 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.03 -48.22 77.16 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.293 -0.879 . . . . 75.54 110.308 171.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 21.8 mt -60.32 -21.38 61.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.928 0.891 . . . . 75.34 112.0 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -81.85 -28.38 33.06 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.286 0.634 . . . . 75.25 110.917 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.28 11.27 1.99 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.208 1.403 . . . . 72.33 112.11 -167.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.06 5.36 53.29 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 124.465 1.031 . . . . 73.22 112.48 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.8 mt -97.51 145.44 29.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 118.267 1.034 . . . . 62.44 111.022 -165.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.87 179.58 3.13 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 125.187 3.925 . . . . 72.23 112.72 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -54.91 8.83 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 120.567 -1.333 . . . . 75.43 109.026 172.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -65.39 -31.97 73.35 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 113.369 0.877 . . . . 74.21 113.369 -160.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.4 t -74.68 -54.09 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.738 -1.208 . . . . 75.31 107.738 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.17 -35.88 38.34 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.929 1.292 . . . . 51.32 112.033 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -36.14 68.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.098 0.959 . . . . 73.12 112.585 177.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.46 -34.96 16.25 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.082 -1.011 . . . . 74.23 110.16 172.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.19 -25.05 60.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.629 1.171 . . . . 75.54 112.715 -168.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -56.68 -47.6 79.49 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.071 0.948 . . . . 75.51 110.761 175.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.94 -30.45 64.03 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.939 1.695 . . . . 64.44 112.144 -174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.3 mt -64.58 -31.62 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.834 0.853 . . . . 75.44 109.328 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -85.94 -21.73 27.77 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.506 0.558 . . . . 72.22 112.506 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 64.1 t -65.91 -50.94 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 118.694 0.679 . . . . 70.22 110.472 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.63 -7.25 53.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.628 0.771 . . . . 73.44 112.995 -161.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 80.93 29.66 41.33 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.637 -0.664 . . . . 62.4 112.398 -170.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.482 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.3 mt -76.34 -44.85 34.81 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-N 117.848 0.824 . . . . 73.12 109.411 173.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.3 m -144.96 149.38 16.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 118.256 0.48 . . . . 74.31 110.953 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.39 147.18 38.21 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.674 -0.861 . . . . 74.14 108.674 160.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -62.66 -43.62 98.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.944 -0.472 . . . . 74.43 110.161 171.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.6 m -79.89 19.56 0.68 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.085 0.772 . . . . 75.33 113.085 172.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.93 -42.47 48.72 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 120.319 1.418 . . . . 75.22 108.758 157.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -62.45 131.56 49.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.733 0.813 . . . . 71.34 110.054 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.86 170.1 10.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.719 1.207 . . . . 74.4 109.712 169.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.07 -30.56 62.16 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.046 1.338 . . . . 75.31 112.307 -173.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.48 -37.36 78.03 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.369 0.668 . . . . 75.41 110.928 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.82 34.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.632 0.773 . . . . 42.41 111.125 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.8 mm -58.71 -49.06 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.683 0.793 . . . . 74.41 109.183 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -55.63 -56.7 17.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.154 1.382 . . . . 75.13 109.76 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.56 75.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.724 0.809 . . . . 63.51 111.774 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mt -57.86 -38.01 74.92 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 113.007 0.743 . . . . 74.44 113.007 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.94 -32.89 74.82 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.566 0.621 . . . . 74.53 111.506 174.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -73.73 -15.6 61.21 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.006 0.743 . . . . 63.45 113.006 -171.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -89.18 132.85 34.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 119.076 0.853 . . . . 75.32 110.502 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -65.03 175.33 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.263 -1.335 . . . . 75.15 111.749 166.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -48.32 -64.07 0.9 Allowed 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.935 2.094 . . . . 74.52 111.788 -176.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.71 -36.69 57.03 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 122.831 0.452 . . . . 72.42 110.887 -175.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.61 -36.33 93.21 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 111.182 -0.767 . . . . 74.02 111.182 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.78 61.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.168 0.987 . . . . 75.42 109.911 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.09 -39.02 77.53 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.204 0.456 . . . . 75.25 110.286 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.42 91.89 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.292 0.637 . . . . 73.03 111.762 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -54.31 -44.35 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 109.42 -0.585 . . . . 75.12 109.42 173.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.9 mt -70.28 -47.05 62.94 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.339 -0.986 . . . . 72.41 108.339 -169.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -56.58 -56.17 24.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.46 1.504 . . . . 73.23 110.242 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -62.58 -41.0 98.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.408 1.099 . . . . 73.1 109.66 -174.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.66 -49.68 75.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 125.184 1.394 . . . . 75.42 110.797 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.482 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -71.39 -28.89 64.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.965 -1.084 . . . . 75.1 113.415 -179.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -75.73 -1.09 23.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.253 0.621 . . . . 72.22 111.463 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 m -83.77 172.05 12.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.585 1.539 . . . . 74.21 109.63 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -117.48 91.37 3.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.21 1.004 . . . . 73.34 110.301 -171.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.9 mt -79.99 -2.81 45.69 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.081 0.952 . . . . 74.52 113.417 -166.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.7 t -47.96 -60.92 2.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.174 1.79 . . . . 61.43 110.56 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -88.05 31.15 0.8 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.294 1.038 . . . . 73.32 111.899 -172.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -123.03 120.75 61.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 106.77 -1.567 . . . . 74.34 106.77 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -73.05 -51.01 19.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.874 0.87 . . . . 73.12 109.23 175.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -106.71 80.97 1.51 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 127.192 2.197 . . . . 72.53 108.195 -160.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -51.76 -37.4 51.15 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.262 -1.336 . . . . 74.24 111.251 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.9 p -64.08 -56.4 15.22 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 124.203 1.001 . . . . 73.24 109.824 -173.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.77 -36.34 72.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.33 0.652 . . . . 63.41 111.053 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.26 -53.82 46.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.69 -0.804 . . . . 75.33 109.499 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -53.84 52.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.338 1.455 . . . . 71.33 109.598 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.1 t -62.0 -31.64 72.03 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.009 -0.996 . . . . 60.42 110.105 -175.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.0 -49.22 68.31 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 118.932 -0.926 . . . . 62.34 111.411 169.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -59.18 -47.08 91.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 118.517 1.159 . . . . 75.14 109.527 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 35.3 mtt -53.41 -47.5 69.53 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.69 -0.631 . . . . 74.32 110.53 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -58.8 -45.48 89.8 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.838 -0.601 . . . . 75.53 110.049 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -47.05 86.79 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.852 0.751 . . . . 72.41 110.556 174.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -60.3 -42.94 96.58 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 113.056 0.762 . . . . 75.42 113.056 -177.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -69.02 -11.01 60.4 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.815 0.734 . . . . 72.52 111.339 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 . . . . . 0 N--CA 1.438 -1.049 0 C-N-CA 125.427 1.491 . . . . 73.51 110.107 -175.665 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.563 0 CA-C-O 121.253 0.363 . . . . 54.31 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.86 -173.95 4.87 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.575 1.95 . . . . 64.33 109.276 163.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.1 pm0 -77.33 -26.32 51.98 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 120.733 -1.229 . . . . 75.35 112.918 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -58.47 -20.49 45.78 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.281 0.946 . . . . 63.12 113.16 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -48.61 -46.89 40.18 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.526 1.131 . . . . 75.24 112.266 -176.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -65.99 -40.06 90.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.876 0.47 . . . . 75.42 111.5 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.2 m -59.9 -37.93 80.82 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.986 0.914 . . . . 75.44 110.31 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -72.27 -44.16 63.21 Favored 'General case' 0 CA--C 1.52 -0.194 0 C-N-CA 123.947 0.899 . . . . 74.24 111.253 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.67 -26.35 44.22 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.787 0.835 . . . . 74.22 111.351 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.96 -17.79 39.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.783 0.833 . . . . 74.43 112.632 -178.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.04 19.78 5.44 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.255 1.422 . . . . 73.22 113.72 -161.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.95 23.8 75.48 Favored Glycine 0 CA--C 1.525 0.667 0 O-C-N 121.577 -0.702 . . . . 54.43 112.512 -173.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.1 mt -112.06 146.17 34.28 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 124.959 1.304 . . . . 74.54 109.173 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.05 165.84 31.06 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.508 2.139 . . . . 72.11 111.09 177.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -60.17 -41.31 92.6 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.683 0.793 . . . . 74.22 108.891 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -58.02 -44.69 87.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.446 -0.797 . . . . 74.44 111.718 -171.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.4 t -70.94 -48.97 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.557 -1.275 . . . . 74.25 107.557 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.54 67.85 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.106 0.78 . . . . 72.25 113.106 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -50.35 -41.04 50.88 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.333 1.453 . . . . 75.14 113.893 172.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.52 -24.28 19.69 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 118.507 -0.759 . . . . 74.21 112.165 177.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.01 -34.52 43.93 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 118.962 0.801 . . . . 74.22 111.088 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -57.09 -41.35 78.71 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.872 0.844 . . . . 73.05 111.164 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -27.71 52.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 127.886 2.474 . . . . 74.22 112.446 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 23.3 mm -71.51 -37.3 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 N-CA-C 107.726 -1.213 . . . . 71.42 107.726 -177.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -83.03 -10.52 58.7 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.454 1.102 . . . . 75.02 112.471 -176.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.3 t -73.77 -42.73 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 O-C-N 121.213 -0.929 . . . . 63.24 109.803 171.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.88 37.1 2.64 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.726 0.81 . . . . 53.54 112.152 -144.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.01 18.63 57.74 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 124.954 1.264 . . . . 74.34 115.085 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.2 mt -85.12 -65.78 0.97 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.348 1.074 . . . . 72.02 109.165 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.3 m -139.39 166.54 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.823 1.249 . . . . 74.23 110.369 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.49 162.93 12.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.234 1.413 . . . . 51.41 108.558 156.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -58.32 -35.36 71.76 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.847 0.748 . . . . 72.53 110.604 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.1 p -81.69 -5.31 57.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.537 1.135 . . . . 75.11 112.303 -174.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.61 -16.93 46.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.866 0.757 . . . . 63.41 112.471 -169.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -90.61 -175.24 4.36 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.133 1.773 . . . . 71.55 110.55 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -114.02 170.77 8.03 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.213 1.405 . . . . 72.52 109.828 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -46.57 -44.74 18.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.959 1.304 . . . . 72.41 110.608 164.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -64.49 -22.79 67.07 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.774 0.657 . . . . 72.43 112.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.28 -52.49 18.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.138 0.881 . . . . 71.13 109.902 171.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.02 -53.81 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 C-N-CA 125.144 1.377 . . . . 64.41 109.35 -175.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -64.02 -44.64 91.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.613 -0.232 . . . . 74.14 111.372 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.58 -38.52 87.83 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.178 -0.304 . . . . 75.34 110.178 -176.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 mt -52.59 -41.63 63.8 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.604 0.762 . . . . 75.12 111.952 173.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -59.22 -55.13 38.84 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.453 0.57 . . . . 75.51 110.081 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -74.18 -1.19 19.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 116.281 1.956 . . . . 73.31 116.281 -162.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.7 159.27 25.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.127 0.971 . . . . 74.33 110.309 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.7 p-10 -75.77 -179.65 4.9 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.185 0.994 . . . . 72.43 109.426 159.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -44.77 -70.87 0.09 Allowed 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 126.978 2.111 . . . . 75.24 110.722 171.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.26 -28.97 60.03 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 112.072 0.397 . . . . 75.05 112.072 -166.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.64 -40.44 94.04 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 110.416 -1.074 . . . . 62.45 110.416 174.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.75 -49.29 76.99 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.48 -0.771 . . . . 75.13 110.374 171.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.46 -38.85 72.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.589 1.086 . . . . 75.43 111.309 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -50.45 73.95 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.783 1.233 . . . . 71.35 111.069 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 63.2 t -52.28 -42.19 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.316 0.647 . . . . 75.22 110.141 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -71.49 -45.64 61.95 Favored 'General case' 0 CA--C 1.516 -0.345 0 O-C-N 122.345 -0.222 . . . . 75.34 110.414 -169.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -54.05 -56.86 14.01 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.88 1.272 . . . . 64.01 108.935 173.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -70.56 -6.68 38.26 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.099 0.777 . . . . 74.24 113.099 -168.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -93.87 -38.91 10.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.027 1.731 . . . . 74.22 111.701 174.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -60.49 -35.27 75.53 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.64 1.109 . . . . 75.25 109.579 165.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -79.46 46.51 0.75 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.904 1.682 . . . . 64.02 109.077 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.2 m -153.76 167.07 30.84 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.304 -1.498 . . . . 74.42 111.705 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -99.78 116.33 31.62 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 126.529 1.932 . . . . 72.41 106.416 175.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.8 mt -114.03 8.7 17.16 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 126.589 1.956 . . . . 74.12 109.92 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 m -75.27 -58.82 3.05 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 126.978 2.111 . . . . 75.24 108.775 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -78.03 0.67 23.64 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 113.34 0.867 . . . . 75.35 113.34 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 48.9 t -82.7 141.25 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 120.937 -1.102 . . . . 62.52 109.819 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -69.13 0.54 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.428 1.491 . . . . 75.21 110.282 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -111.42 100.93 9.43 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 127.34 2.256 . . . . 73.45 107.912 -163.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -60.64 -31.98 71.17 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.495 1.118 . . . . 74.45 112.83 -165.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -57.0 -49.17 76.6 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.848 1.659 . . . . 74.15 108.757 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.12 -5.63 36.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 113.458 0.91 . . . . 51.23 113.458 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -91.0 -56.33 3.21 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 119.872 -0.731 . . . . 73.11 109.38 163.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -50.8 70.27 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 126.117 1.767 . . . . 75.32 109.674 -165.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.7 t -55.09 -36.16 65.36 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.239 -1.346 . . . . 71.23 109.473 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.95 -42.04 97.06 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.002 -0.888 . . . . 75.35 112.7 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.7 t -60.53 -46.35 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 119.097 1.449 . . . . 60.54 108.653 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.4 mtt -58.54 -40.44 83.02 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.604 -0.685 . . . . 74.15 109.995 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -53.75 54.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.485 -0.769 . . . . 62.35 110.963 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -63.05 -42.94 99.84 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.7 -0.667 . . . . 63.44 109.788 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -60.09 -38.04 81.76 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.742 1.61 . . . . 75.04 112.523 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -21.33 59.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.592 0.757 . . . . 75.23 110.242 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 126.263 1.825 . . . . 75.33 111.423 -177.001 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.794 0 N-CA-C 111.384 -0.686 . . . . 72.0 111.384 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -96.36 -167.77 1.63 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.552 1.141 . . . . 75.42 110.28 166.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.07 -33.22 51.07 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 125.773 1.629 . . . . 71.11 113.264 -175.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.95 -41.93 97.24 Favored 'General case' 0 C--O 1.227 -0.114 0 C-N-CA 124.797 1.239 . . . . 64.44 110.168 -179.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -45.94 -60.93 1.97 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.945 1.698 . . . . 75.14 112.754 -170.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -63.38 -33.41 75.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.223 -0.417 . . . . 74.34 111.494 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.15 -39.61 86.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.462 -0.78 . . . . 73.23 109.364 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.12 96.07 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 120.011 1.278 . . . . 72.4 109.71 174.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.26 -16.81 61.44 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.996 0.918 . . . . 71.24 112.879 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -105.71 -17.79 14.28 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.26 1.824 . . . . 64.0 110.767 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.32 30.29 0.71 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 127.507 2.323 . . . . 74.4 110.813 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 82.38 3.2 90.63 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-O 117.784 -1.564 . . . . 71.1 114.277 173.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.2 mt -104.29 157.24 34.48 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.939 1.87 . . . . 73.13 112.92 -172.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.67 170.58 19.9 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 124.346 3.364 . . . . 63.3 113.739 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -66.4 -47.63 72.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 124.985 1.314 . . . . 74.43 109.728 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -42.52 86.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.16 0.43 . . . . 72.23 112.16 -166.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.93 -57.12 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 126.791 2.036 . . . . 75.3 107.285 173.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.14 -42.69 63.56 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 124.659 1.184 . . . . 73.14 112.491 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.11 -45.55 71.9 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.04 0.936 . . . . 74.33 110.217 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -38.54 28.07 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 119.289 -0.386 . . . . 75.44 110.6 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.33 -41.38 94.0 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.736 1.215 . . . . 75.02 110.88 -174.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.23 -44.31 75.34 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.885 1.274 . . . . 75.31 110.547 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -33.36 67.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.453 1.101 . . . . 73.44 112.858 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -66.93 -25.25 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.78 0.832 . . . . 74.03 109.483 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.68 -31.84 14.29 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.08 0.952 . . . . 74.31 111.855 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -53.19 -53.47 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.475 0.71 . . . . 75.31 110.883 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 1.75 17.13 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.755 0.65 . . . . 72.03 112.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.08 25.88 72.27 Favored Glycine 0 CA--C 1.528 0.885 0 O-C-N 120.782 -1.199 . . . . 54.54 112.88 174.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.437 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 1.8 mp -59.88 -43.88 94.5 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.203 1.501 . . . . 75.14 108.067 168.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -132.01 168.63 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 126.278 1.831 . . . . 75.24 108.224 167.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.97 161.29 13.81 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 107.862 -1.162 . . . . 73.2 107.862 165.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -59.28 -10.22 2.84 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.095 1.517 . . . . 75.23 115.095 -172.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.69 42.86 3.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.101 1.76 . . . . 73.4 109.73 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -74.47 -10.15 59.28 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 127.793 2.437 . . . . 72.0 113.647 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 mt -101.24 158.56 15.95 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 122.958 0.503 . . . . 71.34 112.142 -167.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -91.2 163.2 14.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.999 1.32 . . . . 74.03 109.351 167.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -46.99 -51.94 15.93 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.188 2.195 . . . . 72.42 111.784 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -76.79 -9.27 58.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.362 -0.828 . . . . 75.34 111.353 -172.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.26 -47.59 41.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.197 -1.382 . . . . 75.22 109.387 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.72 -52.09 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 120.597 1.544 . . . . 72.11 109.901 174.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.91 -40.44 88.82 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.969 0.729 . . . . 64.0 112.969 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.2 -23.24 54.65 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.502 1.046 . . . . 72.23 112.67 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.88 -32.03 73.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.16 0.984 . . . . 74.0 110.415 171.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.439 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 1.0 OUTLIER -62.13 -13.18 24.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.819 1.247 . . . . 72.43 112.89 174.13 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -104.85 2.99 30.54 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.047 0.939 . . . . 65.33 112.852 -171.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -97.47 160.25 14.44 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 120.626 -1.297 . . . . 74.0 109.98 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -86.73 178.4 7.03 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.349 1.46 . . . . 73.14 110.107 164.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -52.35 -68.04 0.2 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 127.275 2.23 . . . . 72.31 110.153 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.02 -34.0 77.08 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.92 -0.488 . . . . 75.12 111.781 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.39 -59.5 9.81 Favored Glycine 0 C--N 1.34 0.763 0 N-CA-C 109.616 -1.394 . . . . 52.24 109.616 177.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.86 -45.26 63.99 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.514 0.726 . . . . 71.31 111.891 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.63 -37.35 81.17 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.903 0.774 . . . . 74.41 111.761 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.91 -46.39 74.99 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.561 0.619 . . . . 73.3 110.321 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.2 t -57.62 -40.78 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 118.608 0.64 . . . . 73.34 110.747 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.99 -49.07 77.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.421 1.088 . . . . 75.4 109.824 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -57.53 -52.0 67.2 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.373 -0.83 . . . . 72.31 109.107 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -69.83 -26.21 64.12 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.425 0.557 . . . . 74.34 111.633 -170.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -62.14 -67.66 0.39 Allowed 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.951 -1.129 . . . . 73.0 107.951 168.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 4.4 tppp? -48.8 -37.28 18.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.192 0.997 . . . . 71.14 111.583 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -72.75 28.14 0.06 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.229 1.411 . . . . 74.14 112.935 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.8 m -142.27 157.84 44.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.733 1.613 . . . . 75.11 108.989 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.16 79.49 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 124.364 2.03 . . . . 72.33 108.423 -153.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.401 ' O ' ' HE2' ' A' ' 69' ' ' LYS . 70.0 mt -72.57 -0.2 12.19 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 127.24 2.216 . . . . 74.41 115.187 -165.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.4 t -56.4 -45.6 80.56 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.8 1.182 . . . . 74.43 111.368 -163.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -106.44 64.08 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.687 -0.857 . . . . 72.42 108.687 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.1 t -131.73 124.92 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 N-CA-C 106.87 -1.53 . . . . 75.44 106.87 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.439 ' H ' ' CD ' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -65.24 -54.27 31.8 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.686 0.794 . . . . 72.24 109.134 178.333 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -115.18 71.88 0.78 Allowed 'General case' 0 C--N 1.335 -0.065 0 C-N-CA 125.669 1.587 . . . . 75.32 110.741 -156.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 63' ' ' LEU . 30.1 mmtp -46.95 -36.8 8.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 127.02 2.128 . . . . 71.0 112.916 178.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.31 -50.53 67.47 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 125.329 1.452 . . . . 74.31 111.077 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.9 71.93 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.967 0.507 . . . . 61.04 110.569 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -57.29 -54.96 40.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.625 -0.88 . . . . 72.2 108.625 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.41 -46.92 87.34 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.699 0.4 . . . . 75.14 110.532 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 33.1 t -53.55 -41.82 66.85 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.651 0.78 . . . . 71.31 110.856 177.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.58 -53.41 43.84 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.969 -0.853 . . . . 73.42 110.969 176.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -57.29 -45.38 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 123.222 0.609 . . . . 73.01 109.386 177.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.3 mtt -55.78 -44.33 77.63 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.969 -1.082 . . . . 75.22 111.717 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -57.16 -53.59 56.41 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 118.792 -0.623 . . . . 72.41 109.453 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 m -58.68 -43.26 89.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.351 0.407 . . . . 55.31 110.848 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -61.92 -38.49 88.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.959 -1.088 . . . . 74.04 112.463 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.72 -11.58 59.84 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.711 -1.243 . . . . 74.02 112.438 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.232 0.146 0 C-N-CA 124.815 1.246 . . . . 71.33 109.481 -176.575 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 N-CA-C 109.443 -1.463 . . . . 71.15 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.65 -167.2 1.22 Allowed 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.937 -1.134 . . . . 54.42 107.937 161.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.97 -29.48 70.84 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.714 1.606 . . . . 74.31 112.348 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.46 -36.75 76.56 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.105 0.866 . . . . 73.54 110.264 -171.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -44.39 -53.4 6.86 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.495 1.918 . . . . 74.25 112.495 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.6 tp60 -61.88 -41.93 98.46 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 119.064 -0.493 . . . . 74.15 110.844 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.0 m -67.0 -37.28 83.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.539 -0.541 . . . . 72.14 109.539 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -36.75 82.44 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.281 -0.887 . . . . 72.22 111.295 176.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -23.33 67.22 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.365 0.53 . . . . 71.23 111.084 176.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -87.85 -24.28 23.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.962 0.801 . . . . 72.24 112.08 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.38 11.99 1.38 Allowed 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.101 2.161 . . . . 73.35 112.724 -164.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 16.12 46.29 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-O 117.954 -1.47 . . . . 71.24 114.168 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.7 mt -119.79 157.02 53.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.773 1.286 . . . . 73.55 113.184 -171.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.23 172.49 15.95 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 124.657 3.571 . . . . 74.11 113.178 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -73.45 -43.72 59.72 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.972 1.309 . . . . 74.24 110.278 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.91 -38.48 72.91 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.992 -0.283 . . . . 71.24 111.611 -171.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.3 t -70.74 -52.31 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 127.227 2.211 . . . . 74.15 107.146 176.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.02 -42.25 62.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.889 1.275 . . . . 70.12 112.112 -173.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -52.79 -55.04 25.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 73.53 110.39 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.55 -27.26 58.58 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 118.568 -0.73 . . . . 74.32 111.308 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.3 tp -74.69 -41.63 59.9 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.001 0.92 . . . . 70.35 110.994 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -54.65 -45.97 73.89 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.06 0.944 . . . . 73.53 110.121 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.434 ' CD ' ' HZ3' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -49.63 -37.57 28.6 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 126.999 2.12 . . . . 65.23 112.403 176.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.41 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 108.688 -0.856 . . . . 73.55 108.688 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.422 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 19.7 m-85 -80.98 -4.03 53.67 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.884 1.274 . . . . 74.13 112.74 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 42.2 t -85.42 -44.49 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.787 1.176 . . . . 75.55 110.752 175.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.83 -4.29 42.84 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.1 0.778 . . . . 72.53 113.1 -162.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.12 -14.84 64.55 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 125.202 1.382 . . . . 73.13 113.179 -176.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.9 mt -53.47 -51.66 62.02 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.681 1.593 . . . . 73.55 110.951 -172.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.47 160.09 37.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 O-C-N 123.532 0.52 . . . . 64.32 111.899 168.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.46 159.68 20.72 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 108.504 -0.924 . . . . 74.43 108.504 156.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 29.1 p80 -59.97 -31.44 69.9 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.934 -0.555 . . . . 73.45 112.088 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.428 ' C ' ' H ' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -94.74 2.05 55.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.373 -0.823 . . . . 73.12 112.331 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -77.34 15.04 0.81 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.583 1.538 . . . . 54.31 112.694 -177.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.428 ' H ' ' C ' ' A' ' 33' ' ' SER . 51.3 mt -118.09 -170.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.43 2.692 . . . . 74.15 106.747 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -132.55 172.63 12.25 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 107.48 -1.304 . . . . 74.41 107.48 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -52.76 -36.61 58.22 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.668 0.787 . . . . 63.24 110.825 171.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -54.63 -32.09 58.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.689 -0.632 . . . . 74.24 112.37 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.77 -46.01 22.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.565 0.746 . . . . 64.33 110.963 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.1 mm -55.23 -53.16 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 N-CA-C 107.97 -1.122 . . . . 74.55 107.97 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.43 -45.16 95.49 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 125.102 1.361 . . . . 74.51 110.336 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.58 84.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.329 -0.843 . . . . 74.55 111.918 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.33 -38.83 81.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.239 0.927 . . . . 73.23 111.533 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -61.09 -44.87 96.7 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.145 0.429 . . . . 65.25 109.942 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -69.3 11.99 0.2 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 128.921 2.888 . . . . 73.14 116.1 -165.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -118.33 154.27 32.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.858 1.263 . . . . 73.22 109.55 -175.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.18 176.9 0.1 Allowed 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 122.887 1.327 . . . . 74.51 112.141 155.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -52.23 -65.71 0.51 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.958 2.503 . . . . 73.43 110.313 165.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -32.97 66.51 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.369 0.986 . . . . 62.42 111.973 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.08 -57.24 10.29 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.34 0.971 . . . . 53.25 111.023 168.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.45 -42.87 97.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.659 -0.686 . . . . 74.42 111.297 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.86 -50.26 69.51 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 117.733 -1.127 . . . . 71.54 110.728 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.28 -45.91 69.08 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.632 1.106 . . . . 61.14 111.534 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 55.7 t -53.87 -43.12 56.0 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 124.507 1.123 . . . . 74.31 111.556 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -72.17 -42.53 65.8 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 122.985 0.514 . . . . 73.12 109.994 -175.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -71.25 -41.09 70.56 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 122.49 0.316 . . . . 75.13 110.834 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -69.31 -17.62 63.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.404 -0.518 . . . . 75.43 111.157 173.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -84.95 -41.45 15.89 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-O 119.418 -0.325 . . . . 70.53 110.324 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.434 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 6.6 ttmt -70.91 -19.92 62.54 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.881 0.764 . . . . 75.53 111.362 172.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -75.49 48.23 0.43 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.301 1.44 . . . . 71.34 109.753 168.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.4 m -149.58 152.55 35.67 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.629 -1.919 . . . . 75.14 112.411 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -93.37 78.55 4.43 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.271 1.428 . . . . 63.43 107.498 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.401 ' O ' ' HE3' ' A' ' 69' ' ' LYS . 54.5 mt -79.96 -11.86 59.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.181 -0.918 . . . . 74.22 111.064 -168.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 m -53.1 -30.99 39.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.862 2.065 . . . . 75.22 112.07 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.7 m80 -100.21 14.01 32.31 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.352 1.061 . . . . 75.45 113.862 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.2 t -105.17 135.14 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 121.574 -0.704 . . . . 64.55 109.841 -176.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -68.48 0.32 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.37 1.868 . . . . 70.32 110.534 176.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -111.61 88.92 2.92 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.34 1.456 . . . . 64.41 109.692 -166.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HE3' ' O ' ' A' ' 63' ' ' LEU . 38.9 mmtm -53.21 -31.6 43.87 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.195 1.398 . . . . 73.15 114.07 -172.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.53 25.92 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 128.473 2.709 . . . . 74.43 109.085 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.12 89.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.495 0.718 . . . . 73.23 110.146 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.97 -51.03 69.71 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.33 -0.619 . . . . 63.52 109.33 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -57.57 11.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.473 1.109 . . . . 71.45 108.622 -175.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 2.8 t -62.22 -27.1 68.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.637 -0.71 . . . . 65.55 110.583 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.07 -53.69 40.71 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.855 0.741 . . . . 72.14 111.405 168.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -54.52 -49.26 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 118.285 1.042 . . . . 74.44 108.545 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 18.2 mtt -50.59 -54.04 25.82 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.617 0.767 . . . . 73.41 110.744 177.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -62.56 -43.99 97.44 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.802 -0.444 . . . . 74.55 109.802 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -58.6 -47.5 84.12 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.397 0.679 . . . . 70.31 109.607 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -64.06 -44.01 93.74 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.342 0.519 . . . . 74.53 111.924 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -62.44 -50.74 70.26 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.054 -0.721 . . . . 74.53 109.054 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 CA--C 1.535 0.371 0 CA-C-O 122.836 1.303 . . . . 72.3 110.011 172.434 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.88 0 N-CA-C 109.959 -1.256 . . . . 73.53 109.959 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.34 -176.61 3.03 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.919 1.288 . . . . 72.12 109.588 -168.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -50.99 -37.48 45.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.442 1.097 . . . . 74.23 112.459 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -35.27 76.3 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.56 -0.904 . . . . 72.14 108.56 -168.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -44.08 -53.39 6.42 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.896 1.678 . . . . 75.23 111.541 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -66.58 -43.5 84.79 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.861 -0.336 . . . . 62.44 110.664 -175.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.5 m -61.65 -38.59 88.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.25 0.62 . . . . 73.23 109.882 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.85 78.63 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.656 1.583 . . . . 75.32 111.692 178.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.88 -25.49 65.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.344 0.975 . . . . 71.22 110.135 173.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.89 -11.59 26.47 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.411 1.005 . . . . 74.21 111.905 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.15 13.03 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.829 -1.17 . . . . 74.22 112.184 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 106.36 1.89 38.08 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 124.49 1.043 . . . . 51.42 113.622 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.1 mt -100.17 144.84 29.17 Favored Pre-proline 0 N--CA 1.448 -0.563 0 C-N-CA 124.013 0.925 . . . . 74.51 108.688 -160.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.61 164.23 35.16 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 121.639 1.559 . . . . 71.43 110.496 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -62.46 -46.81 86.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 -178.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -36.91 71.0 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 114.219 1.192 . . . . 75.34 114.219 -174.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.4 t -73.96 -52.47 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 107.049 -1.463 . . . . 74.11 107.049 174.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.2 -36.09 51.02 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.381 1.073 . . . . 64.32 112.589 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.62 -56.18 15.05 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.531 0.733 . . . . 74.32 110.738 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.81 -32.88 57.93 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 115.839 -0.618 . . . . 71.33 110.389 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.58 -32.25 67.85 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.451 1.1 . . . . 73.32 111.185 -174.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.59 -45.17 85.61 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.006 1.322 . . . . 75.44 111.567 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -27.45 66.66 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.473 1.109 . . . . 75.41 112.975 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.77 -17.23 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.66 -0.65 . . . . 75.55 109.509 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -97.99 -0.96 43.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.644 1.178 . . . . 75.32 113.227 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.0 t -84.1 -55.6 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.191 -0.943 . . . . 75.23 109.078 175.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.06 36.42 1.21 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.513 1.525 . . . . 61.12 111.469 -151.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 59.28 27.95 63.7 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.378 1.466 . . . . 75.34 115.156 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.417 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 38.5 mt -85.44 -66.02 0.95 Allowed 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.789 0.836 . . . . 74.54 109.207 176.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.99 161.73 35.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.078 0.551 . . . . 72.45 110.789 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.25 158.6 15.51 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.644 2.378 . . . . 73.03 109.588 158.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -58.17 -31.94 67.73 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.204 0.456 . . . . 75.23 111.911 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.4 t -95.21 10.32 36.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.563 0.745 . . . . 72.44 111.959 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -83.03 -12.12 57.49 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 120.679 -1.263 . . . . 74.42 111.193 169.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.98 179.4 5.97 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.964 2.106 . . . . 62.31 109.91 174.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 p30 -139.34 -175.92 4.35 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.526 1.13 . . . . 62.45 110.373 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -55.73 -36.48 67.3 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.388 -0.82 . . . . 75.02 111.642 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.0 mtm-85 -66.73 -18.71 65.51 Favored 'General case' 0 C--N 1.338 0.076 0 CA-C-O 118.859 -0.591 . . . . 75.15 111.294 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.72 -51.92 11.64 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.491 1.042 . . . . 60.24 109.93 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.4 mm -60.8 -50.44 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.225 1.41 . . . . 75.15 110.372 -173.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.22 -44.07 76.55 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.626 -0.509 . . . . 74.24 109.626 -174.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.88 82.04 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 122.761 0.424 . . . . 73.14 111.748 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.42 -45.86 80.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.466 0.575 . . . . 75.0 111.259 178.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -20.61 66.14 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.098 -0.953 . . . . 73.12 111.733 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.406 ' CD ' HH21 ' A' ' 81' ' ' ARG . 2.1 mt-10 -85.42 43.7 1.04 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.423 1.465 . . . . 75.13 111.876 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -139.79 156.32 46.82 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.961 -1.087 . . . . 74.43 110.053 170.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -84.99 178.13 7.69 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.547 0.739 . . . . 71.44 109.947 165.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -49.41 -56.39 9.81 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.088 1.755 . . . . 72.52 112.04 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -81.41 -34.1 31.78 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.028 -0.42 . . . . 71.42 111.625 -172.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.48 87.07 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 111.544 -0.622 . . . . 71.24 111.544 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.96 69.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.947 1.299 . . . . 73.54 109.567 168.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.8 mt -63.52 -35.27 79.93 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 118.061 -0.971 . . . . 75.11 111.502 -178.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.38 87.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.527 1.058 . . . . 72.43 110.853 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -54.66 -41.64 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 121.618 -0.677 . . . . 74.32 110.444 173.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.7 mt -78.27 -33.19 49.74 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.403 -0.811 . . . . 75.31 110.45 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -54.89 -62.5 1.61 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 107.228 -1.397 . . . . 75.34 107.228 167.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -72.97 -10.06 59.4 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.471 0.915 . . . . 74.42 113.471 -164.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -84.18 -61.31 1.84 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.867 0.867 . . . . 71.23 110.535 172.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.417 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 13.4 ttmt -63.79 -30.1 71.23 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.519 1.054 . . . . 74.23 110.573 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -81.88 57.51 3.48 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 124.381 1.073 . . . . 75.55 109.959 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 75.7 m -153.8 177.31 11.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.055 2.142 . . . . 73.43 107.78 161.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -115.75 105.72 13.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.827 2.051 . . . . 74.54 106.614 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.2 mt -94.59 7.25 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.049 0.939 . . . . 75.54 111.985 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.2 m -53.83 126.47 22.3 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.901 -0.777 . . . . 52.05 108.901 165.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 18.5 m80 59.39 10.26 1.75 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.447 1.899 . . . . 72.51 114.869 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.26 135.79 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 107.357 -1.349 . . . . 72.33 107.357 170.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -54.17 -85.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.214 1.806 . . . . 72.11 111.479 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.49 99.96 7.0 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.738 -1.578 . . . . 71.23 106.738 -162.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -62.89 -28.62 70.17 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.586 1.154 . . . . 74.05 111.232 -169.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -51.38 66.64 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.304 1.842 . . . . 64.41 109.26 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.01 -24.41 59.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.736 -0.649 . . . . 73.45 112.085 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -67.07 -56.55 9.57 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 107.053 -1.462 . . . . 72.55 107.053 171.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.73 -52.54 63.56 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.717 1.607 . . . . 75.31 110.118 -173.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 49.5 t -61.96 -28.03 69.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.559 -0.746 . . . . 62.14 110.216 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.67 -47.3 91.24 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.415 -0.803 . . . . 62.13 111.397 173.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.0 t -54.55 -53.68 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 123.944 0.898 . . . . 72.12 109.023 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.2 mtt -56.2 -50.1 72.18 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.015 0.526 . . . . 75.04 110.97 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -54.22 -51.0 65.85 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.649 -0.5 . . . . 75.01 109.649 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -54.59 -48.5 72.08 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 124.514 1.134 . . . . 75.13 109.897 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -64.21 -44.11 92.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.183 0.901 . . . . 75.23 112.55 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.406 HH21 ' CD ' ' A' ' 45' ' ' GLU . 3.9 ttt-85 -70.79 -19.42 62.69 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.186 0.903 . . . . 75.21 111.457 178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 C--N 1.329 -0.3 0 CA-C-O 122.823 1.297 . . . . 73.11 108.944 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.449 0 N-CA-C 110.595 -1.002 . . . . 73.52 110.595 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.45 ' C ' ' H ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -137.11 -167.87 2.18 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.544 -0.539 . . . . 63.53 109.544 -173.161 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.04 23.52 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.606 -1.309 . . . . 73.32 114.32 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . 0.45 ' H ' ' C ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -103.7 -32.97 9.11 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 127.23 2.212 . . . . 72.45 110.457 175.329 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -54.43 -59.38 4.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.516 1.127 . . . . 74.44 112.456 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 tp60 -59.42 -28.8 67.26 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.419 1.088 . . . . 74.21 111.754 -174.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -59.54 -40.52 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.0 0.92 . . . . 65.15 109.509 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.91 -39.38 87.38 Favored 'General case' 0 C--N 1.342 0.27 0 O-C-N 121.672 -0.642 . . . . 70.44 110.97 177.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.41 -20.83 66.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.666 -0.683 . . . . 72.33 110.373 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.55 -6.02 41.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.508 1.123 . . . . 73.42 110.814 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.78 15.27 5.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 119.3 -2.125 . . . . 71.35 112.306 -175.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.94 11.84 64.68 Favored Glycine 0 CA--C 1.526 0.772 0 O-C-N 121.029 -1.044 . . . . 73.24 113.547 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.6 mt -116.06 160.7 34.44 Favored Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 118.861 1.331 . . . . 72.11 113.507 -161.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.14 172.97 12.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.463 2.775 . . . . 61.05 111.557 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.54 -48.0 57.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 118.402 -0.809 . . . . 74.21 110.349 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -53.91 -36.1 62.37 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.271 0.841 . . . . 73.32 113.271 -163.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -70.67 -55.39 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 C-N-CA 127.889 2.475 . . . . 74.03 107.978 177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.12 -41.09 16.83 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.83 1.252 . . . . 72.32 112.162 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -61.63 -21.52 64.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.957 1.466 . . . . 74.44 114.957 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.93 -21.23 11.24 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.568 0.543 . . . . 74.01 112.343 170.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.97 -28.11 65.27 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.214 1.006 . . . . 74.34 111.449 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -52.08 -45.83 64.94 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.292 1.437 . . . . 70.15 111.7 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -65.1 -27.98 69.13 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 127.288 2.235 . . . . 74.35 114.124 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm -57.48 -32.94 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.144 -0.687 . . . . 70.14 109.144 176.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -82.42 -49.92 9.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.4 1.08 . . . . 71.51 110.088 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.6 t -51.74 -41.83 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.495 0.718 . . . . 71.51 112.195 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.2 7.82 3.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.694 1.198 . . . . 71.12 112.113 -171.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.74 -2.27 59.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.119 0.866 . . . . 65.13 113.036 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.6 mt -66.61 -52.11 48.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 124.136 0.974 . . . . 72.12 109.353 -172.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 30.7 m -132.64 162.84 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.721 1.008 . . . . 74.42 113.721 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -99.64 155.68 17.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.412 1.485 . . . . 70.43 109.271 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -70.34 -12.55 61.66 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.466 0.913 . . . . 72.33 113.466 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.3 m -118.63 18.4 13.46 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.576 1.15 . . . . 54.02 111.916 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -68.84 -30.09 68.55 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.311 -0.868 . . . . 71.13 110.228 169.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.07 127.29 32.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.067 1.347 . . . . 73.21 108.902 -175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -83.53 164.08 20.03 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.431 -1.322 . . . . 70.4 107.431 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -44.6 -44.2 8.71 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.067 2.147 . . . . 71.02 113.263 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -51.07 -38.18 50.07 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.876 1.27 . . . . 73.1 113.368 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -84.28 -28.1 27.4 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.111 0.965 . . . . 73.32 111.604 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.0 mm -67.6 -45.24 85.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 109.493 -0.558 . . . . 74.44 109.493 176.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -57.92 -49.09 77.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 109.398 -0.593 . . . . 63.34 109.398 172.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.28 77.59 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 118.756 -0.64 . . . . 73.01 111.419 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mt -56.64 -51.54 68.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 120.197 1.362 . . . . 74.41 112.688 173.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -58.06 -17.12 15.73 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.565 0.95 . . . . 74.11 113.565 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.64 -20.63 53.49 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 120.517 1.508 . . . . 72.3 114.819 -170.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -94.95 160.93 14.36 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.168 0.985 . . . . 63.31 110.979 -168.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -85.09 178.86 7.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.915 1.286 . . . . 73.24 110.794 166.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -36.54 66.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.72 1.608 . . . . 65.22 113.628 -172.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.13 -34.34 10.79 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.269 1.427 . . . . 74.13 109.929 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.31 -43.49 97.25 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.016 -0.834 . . . . 54.2 111.016 178.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.26 81.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.874 1.27 . . . . 72.23 109.783 173.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 mp -61.96 -30.82 71.18 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.939 0.895 . . . . 74.34 111.727 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.75 82.48 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.312 0.96 . . . . 74.31 111.654 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -55.07 -41.06 57.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 109.134 -0.691 . . . . 64.42 109.134 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.55 -51.29 29.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 118.78 -0.629 . . . . 72.01 110.42 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.62 -20.72 65.9 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.038 0.535 . . . . 74.44 112.41 -174.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -87.68 -40.01 14.52 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.636 0.375 . . . . 64.23 110.937 171.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . 0.42 ' CZ ' ' HB2' ' A' ' 73' ' ' LEU . 61.4 t80 -77.16 -36.1 55.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.554 0.946 . . . . 74.13 113.554 -173.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.18 -37.77 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.711 -1.243 . . . . 72.44 109.218 169.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -83.44 2.22 37.74 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.123 2.169 . . . . 71.1 112.112 -173.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m -82.61 152.29 25.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.622 1.201 . . . . 73.33 111.914 174.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -83.29 53.81 2.6 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.439 2.296 . . . . 73.42 109.19 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.44 -0.49 12.68 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.843 1.423 . . . . 74.12 114.843 -163.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.4 m -58.06 -59.71 4.85 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.842 1.201 . . . . 73.2 110.479 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -84.8 53.08 2.59 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.385 1.074 . . . . 74.2 110.389 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.4 t -133.23 121.06 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 106.709 -1.589 . . . . 62.03 106.709 170.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.45 -56.54 4.36 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.29 0.95 . . . . 74.3 109.612 169.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -77.05 72.82 3.62 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.02 1.328 . . . . 74.12 110.705 -172.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -57.79 -39.02 76.54 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.994 -0.441 . . . . 74.21 112.052 -176.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.87 -52.72 55.08 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 127.839 2.456 . . . . 70.22 108.457 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.29 79.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.907 -0.588 . . . . 74.34 110.843 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -62.61 -50.37 71.52 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 109.339 -0.615 . . . . 74.43 109.339 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.42 ' HB2' ' CZ ' ' A' ' 58' ' ' PHE . 1.3 tm? -59.52 -52.06 67.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.938 0.895 . . . . 73.01 109.819 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.8 t -58.36 -37.93 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.306 -0.861 . . . . 72.11 109.502 -177.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.03 -45.04 95.82 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.557 1.075 . . . . 71.33 113.167 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.47 -39.51 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 119.332 1.566 . . . . 73.41 109.587 174.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 mtt -62.72 -35.42 79.7 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.287 -1.508 . . . . 74.2 111.285 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -62.93 -46.01 89.81 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 118.461 -0.78 . . . . 72.4 111.398 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 t -62.14 -47.85 82.72 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 119.667 1.121 . . . . 71.32 108.414 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -63.81 -32.66 74.24 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.093 1.516 . . . . 73.13 115.093 -170.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -77.94 -29.55 50.02 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.969 1.259 . . . . 74.32 112.308 169.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 . . . . . 0 C--O 1.238 0.464 0 C-N-CA 124.519 1.128 . . . . 74.33 109.122 -171.562 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.352 0 N-CA-C 108.576 -1.81 . . . . 61.03 108.576 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 m -97.89 -170.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 123.696 0.798 . . . . 62.02 110.429 -177.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -61.53 -10.14 7.34 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 114.597 1.332 . . . . 72.13 114.597 -175.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -70.69 -43.21 69.51 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 120.305 1.412 . . . . 74.4 108.679 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -47.02 -56.84 5.74 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.65 1.58 . . . . 73.21 112.622 -173.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -59.99 -42.66 94.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.506 0.323 . . . . 73.34 110.958 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -69.83 -36.88 75.96 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 119.03 -0.51 . . . . 75.23 109.734 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -39.42 91.89 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.744 1.156 . . . . 72.1 111.493 175.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.1 mt -63.29 -27.47 69.36 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.104 0.561 . . . . 74.4 111.131 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -90.94 -29.83 17.22 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.325 0.65 . . . . 75.12 110.965 177.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.68 -15.6 41.53 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.029 2.132 . . . . 63.32 111.661 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . 0.429 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 127.04 4.93 5.86 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-O 117.411 -1.772 . . . . 74.43 114.936 167.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.9 mt -98.78 153.87 37.68 Favored Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 118.795 1.297 . . . . 75.3 111.387 -169.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.48 165.91 29.03 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.932 2.421 . . . . 74.21 111.288 171.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -61.73 -40.37 94.85 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 124.463 1.105 . . . . 72.32 109.981 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -59.01 -51.29 70.71 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 123.913 0.758 . . . . 72.13 110.2 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.5 -50.71 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.904 1.282 . . . . 72.33 107.789 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.37 -41.45 76.24 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.574 0.624 . . . . 74.2 112.373 -176.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.53 -40.19 78.26 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.245 1.018 . . . . 72.22 110.865 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.89 -35.49 32.49 Favored 'General case' 0 C--O 1.231 0.089 0 O-C-N 121.828 -0.545 . . . . 72.1 110.03 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.8 tp -77.52 -36.96 51.92 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.926 -0.559 . . . . 74.4 112.313 -170.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -54.27 -40.9 68.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.773 0.715 . . . . 64.13 111.313 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -58.38 -33.72 69.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 128.32 2.648 . . . . 72.13 111.856 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.7 mm -58.78 -40.13 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 125.039 1.336 . . . . 74.31 109.728 178.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.64 -47.07 16.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.166 0.586 . . . . 73.41 109.98 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 93.1 t -53.68 -46.15 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.678 0.791 . . . . 73.23 111.174 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.74 -1.18 13.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.348 0.87 . . . . 74.41 113.348 -176.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.07 32.23 44.99 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 124.292 0.948 . . . . 73.41 112.355 171.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.59 -85.2 0.07 Allowed 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.826 -1.546 . . . . 74.3 106.826 170.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -103.2 175.92 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.441 1.096 . . . . 71.24 110.194 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.47 15.95 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.785 . . . . 74.43 111.447 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -64.43 -9.1 16.14 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.464 1.105 . . . . 75.4 113.857 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.1 t -124.06 8.79 8.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.213 1.805 . . . . 64.0 110.149 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.9 -15.71 63.12 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.515 0.932 . . . . 74.03 113.515 -167.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -101.55 151.0 22.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.901 0.88 . . . . 75.44 111.75 -159.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -81.95 159.3 23.62 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.246 -1.39 . . . . 72.34 107.246 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.13 -28.85 69.93 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.702 -0.624 . . . . 74.4 112.515 -174.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.367 -0.833 . . . . 75.13 112.261 175.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.33 -30.05 60.18 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.969 -0.382 . . . . 74.24 109.969 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mm -64.99 -53.02 46.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.097 -0.705 . . . . 73.14 109.097 170.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.27 -47.38 84.61 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.237 1.015 . . . . 75.15 111.062 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.13 69.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.05 -0.406 . . . . 75.23 111.7 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.7 mt -56.95 -44.85 82.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.597 0.635 . . . . 63.43 111.816 171.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.429 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.4 OUTLIER -54.46 -20.13 7.01 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.566 1.146 . . . . 75.1 113.509 173.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -79.8 -14.45 58.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 120.363 1.438 . . . . 73.44 112.508 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.9 168.28 12.53 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.739 1.616 . . . . 64.01 109.557 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -96.1 -172.84 2.65 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.293 1.837 . . . . 72.34 109.952 165.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.87 -67.56 0.24 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 127.313 2.245 . . . . 73.41 111.386 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -61.84 -36.76 82.14 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.198 0.599 . . . . 72.03 110.811 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -74.7 0.26 Allowed Glycine 0 C--N 1.338 0.673 0 C-N-CA 124.98 1.276 . . . . 73.12 110.517 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.24 -44.02 92.36 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.802 1.241 . . . . 70.24 111.938 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -61.05 -37.25 81.97 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.099 0.959 . . . . 73.11 110.209 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.25 81.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.83 0.741 . . . . 71.31 111.175 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.02 -23.31 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 CA-C-N 118.791 0.723 . . . . 73.33 111.089 178.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -74.81 -46.5 36.36 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 120.392 -1.442 . . . . 74.0 110.298 174.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.48 60.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.911 0.884 . . . . 74.12 111.549 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.97 -25.97 24.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.746 0.308 . . . . 73.21 111.748 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -66.54 -30.3 70.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.836 0.854 . . . . 73.21 112.295 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -78.03 -25.65 47.97 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.098 -1.001 . . . . 74.32 111.524 167.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.18 45.22 0.73 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.904 1.282 . . . . 45.34 111.437 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.5 m -160.84 178.63 9.23 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 71.23 110.663 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -127.8 66.72 1.34 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 129.69 3.196 . . . . 53.52 106.579 -146.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.18 7.22 1.04 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.31 1.844 . . . . 74.33 112.861 -167.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 62' ' ' ASP . 31.6 t -68.63 -6.17 24.27 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 128.348 2.659 . . . . 62.3 111.58 178.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -131.32 38.11 3.65 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.276 1.03 . . . . 71.42 109.984 169.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.56 123.21 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 121.511 0.672 . . . . 74.42 110.042 166.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -80.27 -60.96 2.13 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.141 -0.936 . . . . 74.21 108.906 168.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -80.21 102.94 9.75 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.975 -0.75 . . . . 64.34 108.975 -171.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -73.89 -28.85 61.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.328 -0.851 . . . . 75.14 111.142 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.5 m -66.36 -55.82 14.04 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 124.172 0.989 . . . . 74.4 110.503 -173.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.99 -35.73 77.59 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.726 1.21 . . . . 75.45 110.17 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -63.89 -48.35 76.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.204 0.526 . . . . 75.33 110.611 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.04 -48.94 79.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.63 0.772 . . . . 73.04 110.213 -177.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 3.6 m -55.12 -34.71 63.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.285 1.434 . . . . 74.02 112.307 170.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -60.46 -48.33 86.71 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.145 0.879 . . . . 72.25 111.064 176.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.6 t -61.48 -43.93 97.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 117.548 0.674 . . . . 74.45 109.324 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 31.2 mtt -53.76 -45.51 70.64 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 121.095 -1.003 . . . . 73.35 110.19 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -67.66 -29.51 68.82 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.035 -0.983 . . . . 64.11 112.722 -168.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 15.1 t -72.8 -49.36 31.07 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.351 1.432 . . . . 54.53 108.514 169.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -61.38 -33.53 73.83 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.846 -1.159 . . . . 73.21 113.774 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 -7.16 59.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.341 1.056 . . . . 73.24 112.368 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 C--O 1.239 0.533 0 C-N-CA 125.458 1.503 . . . . 72.35 109.303 177.397 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.221 0 N-CA-C 109.981 -1.248 . . . . 73.42 109.981 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.416 ' H ' ' CG ' ' A' ' 22' ' ' ASP . 3.5 t -140.83 -154.55 0.52 Allowed 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.118 2.567 . . . . 64.44 107.544 -164.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -59.25 -26.37 64.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.161 0.584 . . . . 75.22 111.978 177.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.73 -37.21 67.82 Favored 'General case' 0 C--O 1.227 -0.097 0 CA-C-N 118.539 0.609 . . . . 75.42 110.009 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -49.39 -57.95 6.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.1 1.36 . . . . 51.2 112.643 -166.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -64.28 -35.91 82.39 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 118.821 0.737 . . . . 72.22 112.03 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -38.03 77.11 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.467 -0.568 . . . . 62.1 109.467 -178.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.69 -43.13 99.59 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.6 1.16 . . . . 63.2 109.73 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.5 mt -62.35 -16.33 53.76 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.596 -0.69 . . . . 55.1 112.583 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -104.6 -6.81 20.16 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.242 1.417 . . . . 63.14 112.171 176.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.02 13.6 2.66 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.447 1.899 . . . . 74.44 112.693 -168.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.84 4.36 58.98 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.307 1.432 . . . . 44.42 112.43 -171.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -102.81 158.0 32.62 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 118.727 1.264 . . . . 74.41 110.55 -162.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.01 -164.42 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.733 1 C-N-CA 126.304 4.67 . . . . 74.42 112.916 172.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.77 -54.98 4.19 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 120.379 -1.451 . . . . 74.44 109.599 161.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -50.42 -48.98 55.98 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.412 1.085 . . . . 74.51 113.818 -164.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.81 -46.9 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 125.175 1.39 . . . . 51.44 107.696 -173.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.14 -38.3 68.04 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.476 0.58 . . . . 75.03 111.313 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.73 -16.78 62.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.09 1.145 . . . . 75.54 114.09 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.5 2.25 16.24 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.873 1.215 . . . . 74.2 113.346 170.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -103.55 -34.23 8.74 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.7 1.2 . . . . 74.0 111.058 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.416 ' CG ' ' H ' ' A' ' 2' ' ' SER . 10.0 t70 -56.32 -40.71 74.84 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.272 0.487 . . . . 75.45 110.997 176.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.62 -44.7 9.12 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 128.908 2.883 . . . . 74.35 112.357 174.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -66.8 -19.8 26.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 74.32 110.23 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -100.37 -13.19 18.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.428 1.091 . . . . 75.25 112.637 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.5 t -89.06 -30.14 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.328 1.051 . . . . 75.34 111.165 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -85.01 10.76 11.02 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.115 -0.991 . . . . 75.33 112.973 -167.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.62 24.8 76.07 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.177 0.894 . . . . 74.54 113.815 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.0 mt -79.7 -83.75 0.1 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.229 2.212 . . . . 75.31 107.032 168.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.63 165.99 15.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 123.685 0.794 . . . . 54.51 112.931 -170.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.89 155.01 24.32 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.145 1.378 . . . . 75.13 109.436 164.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -76.1 -12.97 60.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.312 -0.851 . . . . 72.34 113.172 -175.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.1 m -124.91 36.15 4.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.169 1.788 . . . . 75.14 110.364 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -81.57 15.04 2.25 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 120.981 -1.075 . . . . 75.15 112.88 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -113.25 177.17 4.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.276 -1.515 . . . . 72.41 111.077 -163.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -112.81 160.4 18.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.46 1.104 . . . . 75.21 109.232 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.3 -45.23 72.52 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.277 1.031 . . . . 74.11 109.428 173.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtt85 -58.87 -25.96 63.81 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.939 0.896 . . . . 74.15 111.685 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.93 -45.09 29.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.894 0.77 . . . . 72.04 109.557 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.1 mm -58.47 -40.39 78.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.953 0.901 . . . . 75.31 109.394 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.73 -38.64 91.3 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.632 0.651 . . . . 72.03 110.188 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.14 -33.45 65.51 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.59 1.156 . . . . 74.34 111.536 -173.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.16 -46.09 79.42 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.179 0.899 . . . . 74.2 112.791 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -22.77 64.41 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.842 0.457 . . . . 74.41 111.824 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -75.62 -12.35 60.19 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 113.136 0.791 . . . . 75.0 113.136 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -88.81 164.52 15.18 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 119.614 1.097 . . . . 74.0 109.703 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -101.73 -175.84 2.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 125.347 1.459 . . . . 75.44 109.42 169.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -46.25 -58.58 3.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.527 1.531 . . . . 72.21 112.633 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.64 -46.15 83.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 108.186 -1.042 . . . . 73.22 108.186 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.83 -52.38 53.54 Favored Glycine 0 C--N 1.341 0.843 0 N-CA-C 111.3 -0.72 . . . . 62.23 111.3 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.97 91.83 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.557 0.743 . . . . 53.41 110.908 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.0 mt -61.74 -40.12 93.96 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.46 0.573 . . . . 75.34 111.186 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.33 94.21 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.148 0.431 . . . . 74.1 111.419 178.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.44 -41.81 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.594 0.758 . . . . 75.43 109.681 175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.77 -41.9 64.55 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.185 0.594 . . . . 72.4 110.452 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -54.9 -52.15 63.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.68 -0.859 . . . . 75.23 108.68 175.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -68.11 -34.13 75.81 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 119.239 -0.984 . . . . 74.34 110.26 -172.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -65.35 -53.84 37.74 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.856 0.462 . . . . 63.42 110.188 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.29 -41.8 76.5 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.003 0.819 . . . . 75.21 110.002 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.37 16.22 6.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.72 0.637 . . . . 75.22 112.72 -175.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.18 165.82 11.52 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.248 -1.532 . . . . 75.21 112.563 -179.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -88.61 93.21 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.587 -1.642 . . . . 75.52 110.333 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -87.83 53.62 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.838 1.255 . . . . 75.43 110.166 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 p -61.94 83.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.729 2.412 . . . . 75.43 112.279 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.3 m80 51.46 33.55 10.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.365 1.466 . . . . 74.25 112.38 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -52.16 111.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 127.111 2.164 . . . . 63.42 110.55 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -55.17 37.44 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.724 -0.61 . . . . 74.15 112.576 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -114.05 84.3 2.01 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.184 1.794 . . . . 72.15 109.292 -167.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -56.35 -26.83 53.97 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.676 1.191 . . . . 75.25 113.503 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.05 -50.07 57.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 128.32 2.648 . . . . 75.13 109.262 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.8 -38.41 90.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.8 1.24 . . . . 72.04 110.405 -176.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.8 -47.86 83.22 Favored 'General case' 0 C--O 1.23 0.073 0 N-CA-C 109.153 -0.684 . . . . 74.33 109.153 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.3 tp -57.79 -52.59 64.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.336 -0.616 . . . . 63.45 109.336 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.76 -40.32 40.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.904 0.882 . . . . 73.24 111.197 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -44.64 94.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.826 0.727 . . . . 72.25 111.808 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.3 t -65.03 -43.03 96.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 122.087 -0.655 . . . . 64.41 109.799 176.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mtt -57.79 -40.25 79.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 120.799 -1.188 . . . . 62.42 111.323 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -51.82 -59.6 4.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.256 -0.878 . . . . 72.43 109.789 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -62.2 -34.49 76.56 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.898 0.772 . . . . 75.24 111.553 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.06 -37.65 81.53 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 120.603 -1.311 . . . . 75.21 113.1 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -65.86 -45.9 80.42 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.867 0.758 . . . . 75.11 109.229 166.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 . . . . . 0 N--CA 1.446 -0.66 0 C-N-CA 124.484 1.114 . . . . 75.14 110.75 -161.868 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.434 ' HA2' ' OD1' ' A' ' 22' ' ' ASP . . . . . . . . 0 N--CA 1.467 0.753 0 N-CA-C 110.345 -1.102 . . . . 74.03 110.345 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 t -75.35 -170.21 1.16 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.125 0.97 . . . . 61.11 109.031 166.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -35.74 78.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.119 1.368 . . . . 74.43 111.823 167.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -58.87 -26.95 64.72 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.065 0.946 . . . . 63.22 112.811 -169.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -45.86 -41.37 11.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.492 1.917 . . . . 74.02 112.575 175.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -70.12 -37.42 75.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.869 -0.586 . . . . 71.32 111.847 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -39.5 92.73 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.977 0.808 . . . . 63.44 109.005 171.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 40.2 mt -59.57 -48.15 82.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.751 0.705 . . . . 75.45 111.66 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 23.5 mt -51.74 -38.96 57.56 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 123.95 0.9 . . . . 74.0 110.854 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -91.92 -6.96 50.46 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.092 0.557 . . . . 64.44 112.026 -174.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.86 2.17 50.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 120.411 -1.431 . . . . 75.33 110.928 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.79 -22.75 8.05 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 124.358 0.98 . . . . 74.43 112.013 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.15 144.82 67.88 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 117.675 0.737 . . . . 72.04 110.936 -159.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.47 156.23 61.71 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 C-N-CA 121.708 1.606 . . . . 74.02 109.361 164.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -59.4 -39.97 85.13 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 124.192 0.997 . . . . 71.34 108.83 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -56.11 -45.87 79.33 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 112.193 0.442 . . . . 74.13 112.193 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.69 -50.38 50.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 108.254 -1.017 . . . . 72.15 108.254 176.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.92 -42.71 65.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.466 0.706 . . . . 63.11 111.7 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -59.24 -55.6 32.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 119.127 0.876 . . . . 74.03 110.935 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.14 -30.51 69.67 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 118.593 -0.718 . . . . 74.05 111.166 -175.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.4 tp -76.39 -36.91 57.84 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.505 1.122 . . . . 72.12 110.609 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.434 ' OD1' ' HA2' ' A' ' 1' ' ' GLY . 1.1 t70 -55.5 -39.57 70.64 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.749 0.82 . . . . 64.25 110.755 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -29.63 69.41 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.783 1.633 . . . . 74.04 112.299 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.4 mt -65.33 -33.07 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 107.662 -1.236 . . . . 75.42 107.662 -176.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.432 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 11.0 m-85 -90.48 7.82 36.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.382 1.873 . . . . 75.24 112.951 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -99.15 -38.01 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 O-C-N 121.186 -0.947 . . . . 61.41 109.444 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.34 -17.45 59.4 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.25 0.833 . . . . 72.11 113.25 -165.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.4 13.18 52.58 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.413 0.551 . . . . 64.02 111.819 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.9 mt -78.06 -55.29 5.4 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.709 -0.848 . . . . 75.35 108.709 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.3 m -140.16 156.54 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.42 0.688 . . . . 74.33 109.873 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.17 158.66 26.25 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.236 -0.653 . . . . 74.12 109.236 164.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 19.2 p80 -62.26 -24.62 67.37 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.786 -0.571 . . . . 74.21 112.14 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.6 t -107.7 15.74 24.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.173 0.989 . . . . 75.01 111.793 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.38 -23.88 64.72 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.591 -1.318 . . . . 73.32 110.989 171.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.18 173.95 9.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.015 1.726 . . . . 73.11 110.599 -174.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.32 175.37 9.0 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.205 1.002 . . . . 73.35 108.87 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -44.83 -45.14 9.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.443 2.297 . . . . 73.11 114.589 -171.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -60.75 -21.85 63.43 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.958 0.799 . . . . 64.43 112.063 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -58.73 4.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.218 1.007 . . . . 53.21 109.993 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.43 ' H ' HD13 ' A' ' 40' ' ' ILE . 4.4 mp -56.31 -44.89 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.42 1.088 . . . . 71.23 110.924 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -55.45 -48.64 74.17 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.697 1.199 . . . . 75.32 110.987 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.42 86.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 118.408 -0.806 . . . . 72.42 111.101 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -52.95 -37.59 61.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.767 -0.635 . . . . 74.34 111.338 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -29.48 67.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.211 0.819 . . . . 74.22 113.211 174.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -66.99 -21.4 65.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 119.72 1.146 . . . . 71.24 111.366 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -88.27 143.58 26.94 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.323 1.049 . . . . 74.43 110.928 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -69.04 178.52 2.21 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.734 2.013 . . . . 70.13 111.292 163.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -51.14 -65.28 0.58 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.797 2.039 . . . . 73.23 110.939 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -37.67 76.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.723 0.809 . . . . 73.13 110.603 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.74 -37.05 66.84 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 111.431 -0.667 . . . . 44.11 111.431 -175.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.52 91.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.587 0.693 . . . . 71.12 109.496 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 mt -56.41 -37.86 70.76 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.949 -0.47 . . . . 73.02 111.038 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.53 81.47 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.291 0.496 . . . . 72.35 112.271 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 37.4 t -51.45 -38.31 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.801 0.728 . . . . 75.22 110.277 173.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.1 mt -73.2 -53.54 10.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.331 0.653 . . . . 75.01 109.923 -176.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.1 -43.18 73.79 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 124.001 0.813 . . . . 64.25 110.106 -176.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -69.11 -31.13 69.62 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 123.036 0.21 . . . . 70.34 110.957 -174.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -73.3 -49.46 27.38 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.148 0.979 . . . . 75.32 111.461 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -60.71 -38.76 86.15 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.876 1.216 . . . . 65.35 109.733 175.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.31 5.36 20.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.137 0.791 . . . . 74.33 113.137 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.6 p -74.44 170.65 15.24 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 119.929 1.24 . . . . 73.22 111.224 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -96.86 98.73 10.35 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.955 -1.128 . . . . 72.34 107.955 173.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.1 mt -98.99 25.39 6.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.482 1.113 . . . . 75.34 109.848 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 t -67.07 -38.86 86.51 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.26 -0.9 . . . . 72.43 111.16 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -130.97 23.65 4.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.046 0.938 . . . . 73.44 112.396 -170.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.45 165.57 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.393 1.077 . . . . 73.33 110.016 165.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -122.32 -85.68 0.65 Allowed 'General case' 0 C--O 1.234 0.256 0 N-CA-C 106.577 -1.638 . . . . 73.34 106.577 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.58 116.88 14.69 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.889 -1.152 . . . . 75.43 107.889 176.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -64.15 -35.92 82.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.621 -0.674 . . . . 75.15 111.865 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.11 -52.51 65.22 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 126.193 1.797 . . . . 74.03 108.095 -176.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.54 -25.01 67.82 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.357 -0.838 . . . . 72.35 112.768 -175.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -74.85 -52.88 10.2 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.715 -0.846 . . . . 74.44 108.715 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.425 ' CD1' ' HE3' ' A' ' 77' ' ' MET . 0.7 OUTLIER -61.28 -52.99 62.4 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.49 1.138 . . . . 75.04 109.109 -173.476 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.0 t -62.96 -20.75 65.55 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.407 -1.27 . . . . 74.12 110.741 -176.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.94 -53.44 5.79 Favored Glycine 0 C--N 1.34 0.787 0 CA-C-O 117.408 -1.773 . . . . 73.15 110.878 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 53.7 t -47.72 -50.58 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.148 1.474 . . . . 73.03 109.327 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.425 ' HE3' ' CD1' ' A' ' 73' ' ' LEU . 6.6 mtt -53.46 -50.98 64.15 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 119.6 -0.238 . . . . 72.13 111.007 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HA ' HH11 ' A' ' 81' ' ' ARG . 3.5 ttmt -59.67 -47.44 85.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.612 -0.709 . . . . 74.45 110.621 -177.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.1 m -60.2 -38.58 83.73 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.134 -0.936 . . . . 61.02 111.064 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.89 -58.18 9.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.871 1.214 . . . . 74.31 111.1 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.431 HH11 ' HA ' ' A' ' 78' ' ' LYS . 6.2 ptp85 -57.88 -35.41 70.94 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 118.033 -0.984 . . . . 73.31 110.974 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 . . . . . 0 CA--C 1.548 0.885 0 C-N-CA 126.662 1.985 . . . . 71.35 114.381 -172.514 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.372 0 N-CA-C 109.74 -1.344 . . . . 61.14 109.74 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 t -127.36 -177.29 4.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.288 1.994 . . . . 74.1 111.196 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.48 -20.14 64.58 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 113.555 -1.657 . . . . 62.52 112.794 167.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -74.43 -27.64 60.7 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.591 1.087 . . . . 74.44 111.05 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -44.95 -53.46 7.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.324 1.45 . . . . 74.1 111.913 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -64.32 -37.8 88.79 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.97 0.508 . . . . 74.12 112.204 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 m -64.19 -48.78 74.61 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 108.895 -0.78 . . . . 70.24 108.895 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.0 mp -58.87 -42.71 90.1 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 124.094 0.958 . . . . 74.44 110.846 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.8 mt -56.59 -27.26 57.59 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.707 0.803 . . . . 74.43 111.034 177.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -101.05 -3.2 29.78 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.002 0.819 . . . . 54.31 112.764 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -89.5 10.31 23.29 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 120.522 -1.361 . . . . 74.52 112.679 -169.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.85 3.43 42.63 Favored Glycine 0 CA--C 1.527 0.804 0 C-N-CA 125.331 1.443 . . . . 74.23 113.072 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.3 mt -111.68 157.73 38.54 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 118.785 1.293 . . . . 72.13 111.201 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.43 167.89 18.77 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.169 2.579 . . . . 73.32 111.657 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -66.01 -47.42 74.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 124.615 1.166 . . . . 54.22 109.177 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -43.27 83.17 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.525 -0.47 . . . . 74.44 111.155 -172.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.77 -53.84 39.57 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.566 -1.272 . . . . 71.24 107.566 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.22 -51.34 45.05 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.334 1.054 . . . . 64.34 111.628 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -55.18 -45.37 75.79 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.805 0.73 . . . . 73.41 111.536 -178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -38.85 51.72 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 118.449 -0.786 . . . . 72.41 111.031 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.19 -39.24 71.93 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 126.451 1.9 . . . . 73.31 111.099 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.01 -42.26 79.99 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.981 1.313 . . . . 73.14 111.075 -177.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -64.93 -22.66 67.04 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.319 1.448 . . . . 74.34 113.03 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.76 -22.25 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 O-C-N 121.068 -1.02 . . . . 74.0 108.571 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.77 23.55 11.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.683 1.993 . . . . 72.33 112.126 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 91.8 t -115.45 -38.92 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.269 1.028 . . . . 72.5 110.419 174.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.28 5.55 14.4 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.511 -0.743 . . . . 71.1 112.945 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 -8.84 76.93 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 127.329 2.395 . . . . 71.51 113.539 177.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.617 ' CD1' ' HZ3' ' A' ' 59' ' ' LYS . 58.3 mt -61.96 -60.84 3.03 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 126.419 1.887 . . . . 72.42 110.084 -165.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 m -130.34 179.16 4.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.257 -0.883 . . . . 73.11 109.88 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -122.71 164.69 17.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.465 1.106 . . . . 74.54 109.13 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -59.7 -12.09 6.35 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.08 1.141 . . . . 74.43 114.08 -173.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.63 23.99 4.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.01 1.324 . . . . 72.14 112.564 -177.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -73.84 30.66 0.08 Allowed 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.591 -1.318 . . . . 74.52 111.382 169.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.6 mt -125.18 -177.48 3.88 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.079 2.152 . . . . 72.0 110.353 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -137.06 163.03 31.73 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.04 -1.467 . . . . 64.22 107.04 172.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -55.93 -37.99 69.68 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.647 1.579 . . . . 74.4 111.51 -175.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.0 ptt180 -55.53 -36.69 67.02 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.659 0.985 . . . . 71.4 113.659 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.07 -40.5 38.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.413 -0.588 . . . . 72.43 109.413 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.3 mm -60.78 -44.1 96.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 122.995 0.518 . . . . 73.23 110.268 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.46 -50.92 65.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.466 0.706 . . . . 65.31 109.819 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.24 71.15 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 117.644 -1.17 . . . . 63.04 112.68 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.85 -46.39 90.76 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.973 1.261 . . . . 73.2 110.066 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -40.94 98.88 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 118.022 0.374 . . . . 71.31 110.389 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -76.73 43.51 0.34 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.485 1.114 . . . . 65.22 111.999 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -138.41 149.59 45.66 Favored 'General case' 0 C--O 1.233 0.193 0 O-C-N 121.087 -1.008 . . . . 72.42 108.317 162.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -68.62 163.66 23.21 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.331 1.452 . . . . 73.12 110.358 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -47.83 -70.99 0.08 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 127.455 2.302 . . . . 71.12 110.864 -179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -70.52 -23.28 62.61 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.28 -0.263 . . . . 74.12 111.24 -172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.85 -60.74 5.83 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 109.938 -1.265 . . . . 73.01 109.938 176.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -47.63 -40.94 20.93 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.582 1.953 . . . . 63.24 111.884 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -46.86 83.29 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.668 1.187 . . . . 74.43 111.576 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.71 -45.84 81.6 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.036 0.446 . . . . 73.32 109.837 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.74 -37.89 62.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 123.283 0.633 . . . . 74.44 110.975 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.56 -45.37 75.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.192 -0.942 . . . . 73.4 109.938 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -56.04 -49.73 72.91 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.98 -0.748 . . . . 74.44 108.98 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -65.41 -28.2 69.08 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.14 0.427 . . . . 74.44 111.878 -174.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.86 -33.89 51.95 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.764 0.826 . . . . 71.03 112.943 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.617 ' HZ3' ' CD1' ' A' ' 29' ' ' LEU . 0.1 OUTLIER -63.04 -37.84 88.81 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.82 -1.175 . . . . 72.0 110.005 168.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -83.76 52.63 2.32 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.903 2.481 . . . . 74.41 109.995 -175.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.62 170.97 17.88 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.42 1.088 . . . . 71.3 110.457 170.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.46 77.4 1.09 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 125.746 1.619 . . . . 73.21 108.017 -169.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.17 49.53 0.69 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.161 1.384 . . . . 74.41 110.977 -175.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -111.12 -21.51 11.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.201 1.8 . . . . 72.22 112.205 -175.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -130.64 16.58 5.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.239 1.016 . . . . 74.22 111.776 176.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.5 t -90.52 104.85 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 107.586 -1.264 . . . . 73.0 107.586 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -58.43 -35.42 72.07 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.709 0.633 . . . . 74.03 112.709 175.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.5 p30 -129.07 78.74 1.87 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.988 0.899 . . . . 63.02 111.472 -170.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.0 mmtt -48.26 -40.68 25.46 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.516 1.526 . . . . 72.41 110.445 177.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.6 p -55.22 -61.01 2.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.443 2.697 . . . . 72.23 111.364 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.7 -29.81 70.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 119.111 -0.471 . . . . 73.21 111.278 -177.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -63.07 -52.23 63.57 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.466 -0.939 . . . . 72.12 108.466 173.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.84 -47.06 81.2 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.047 1.339 . . . . 74.13 109.836 178.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -27.13 68.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.012 0.925 . . . . 72.42 111.907 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.76 -54.84 6.96 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 109.603 -1.399 . . . . 71.14 109.603 176.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 89.0 t -52.36 -48.14 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.867 0.867 . . . . 74.14 109.562 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 36.2 mtt -50.25 -52.27 37.57 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.908 -1.12 . . . . 74.4 111.237 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.28 89.34 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 118.01 -0.995 . . . . 71.43 111.184 -171.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 t -67.74 -28.29 67.51 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.954 1.252 . . . . 74.32 111.178 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.444 ' C ' ' H ' ' A' ' 82' ' ' GLN . 57.7 m-85 -71.32 -46.27 61.06 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.57 1.532 . . . . 74.31 110.612 169.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.78 24.71 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.419 -1.426 . . . . 73.13 113.068 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 80' ' ' TYR . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.466 0 C-N-CA 127.015 2.126 . . . . 73.32 111.753 174.253 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.53 0 N-CA-C 110.574 -1.01 . . . . 72.52 110.574 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -69.18 179.73 1.84 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.382 0.61 . . . . 75.45 109.536 157.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -49.48 -35.9 21.21 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.356 1.463 . . . . 75.35 113.002 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.73 -34.6 74.65 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.184 0.993 . . . . 75.45 109.771 -166.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -44.77 -54.57 6.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.004 1.322 . . . . 71.33 110.486 176.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -66.56 -31.62 72.45 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.974 -1.013 . . . . 63.45 111.848 -176.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -60.08 -46.73 88.62 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.74 1.155 . . . . 75.44 109.63 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.45 -40.48 95.81 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.206 -0.934 . . . . 74.35 110.963 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.41 -20.09 65.25 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.796 0.725 . . . . 75.11 112.139 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -86.87 -36.78 18.24 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.366 1.066 . . . . 71.24 109.081 175.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.06 64.28 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.599 1.96 . . . . 74.13 113.38 -166.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.87 17.0 2.61 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 119.322 -0.71 . . . . 55.13 113.176 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.3 mt -112.8 148.08 38.55 Favored Pre-proline 0 C--O 1.239 0.509 0 CA-C-N 118.133 0.966 . . . . 71.45 111.96 -156.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.07 154.19 70.89 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.793 2.328 . . . . 74.41 109.112 174.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.0 -40.88 78.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 108.024 -1.102 . . . . 71.15 108.024 -168.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -56.53 18.31 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 123.741 0.65 . . . . 74.21 109.862 -175.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.7 t -58.36 -45.37 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 N-CA-C 108.166 -1.05 . . . . 75.44 108.166 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.24 80.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.367 0.877 . . . . 73.21 113.367 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -55.5 -35.74 65.91 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.6 0.76 . . . . 74.31 111.1 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -91.84 -15.89 27.54 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.232 1.413 . . . . 75.11 111.544 -173.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.45 -38.54 34.4 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 124.787 1.235 . . . . 74.32 111.799 171.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -52.68 -48.2 66.68 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 123.949 0.9 . . . . 64.32 109.628 -171.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -64.91 -5.25 5.67 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.082 2.153 . . . . 75.11 115.092 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.1 mt -90.82 -10.72 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 124.386 1.074 . . . . 75.41 109.544 173.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -109.93 6.29 23.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.218 1.407 . . . . 75.53 113.95 -178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -120.14 -5.82 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.779 1.232 . . . . 75.54 111.819 -173.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.68 6.22 23.54 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.269 -1.519 . . . . 74.11 112.311 -172.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.19 12.54 84.05 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.181 0.895 . . . . 63.13 113.614 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.69 -65.19 0.89 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.608 1.963 . . . . 73.15 109.628 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -129.84 156.98 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 N-CA-C 113.765 1.024 . . . . 75.44 113.765 171.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.97 149.86 39.21 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 125.605 1.562 . . . . 70.55 109.945 161.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -55.92 -47.96 76.57 Favored 'General case' 0 C--O 1.228 -0.062 0 C-N-CA 123.634 0.773 . . . . 71.42 110.962 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.1 t -83.77 3.2 34.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.346 0.498 . . . . 72.42 112.346 -172.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -67.48 -28.49 67.9 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.763 -1.211 . . . . 72.15 111.911 -174.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.67 155.24 40.82 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.311 -0.625 . . . . 74.52 109.311 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -111.61 167.02 10.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.388 -0.968 . . . . 74.1 108.388 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.16 -37.42 64.43 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.041 0.536 . . . . 74.4 112.313 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -54.84 -39.52 68.66 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.24 0.473 . . . . 73.0 111.828 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.02 -39.28 66.12 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.955 -0.545 . . . . 74.14 110.955 177.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.66 -46.05 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.972 0.805 . . . . 74.23 108.99 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.39 -55.73 30.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.854 1.662 . . . . 74.13 110.298 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.65 76.52 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.852 0.461 . . . . 74.03 111.176 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.49 -52.49 65.18 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.226 1.011 . . . . 73.24 110.642 173.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.53 -18.95 3.19 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 117.575 -1.202 . . . . 63.44 113.6 171.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -86.37 -7.13 58.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 121.896 2.134 . . . . 61.4 114.877 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -90.15 -177.34 5.12 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.547 1.521 . . . . 74.11 110.948 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -105.67 173.52 6.28 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 124.971 1.308 . . . . 73.34 108.962 162.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -53.85 -69.87 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 126.065 1.746 . . . . 75.42 111.144 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -68.47 -10.81 57.91 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.86 1.664 . . . . 75.3 111.581 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.24 -72.98 0.96 Allowed Glycine 0 C--N 1.339 0.719 0 N-CA-C 108.504 -1.838 . . . . 62.22 108.504 172.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.83 -36.95 49.95 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.142 0.977 . . . . 74.23 112.343 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.73 -44.97 94.82 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.909 0.884 . . . . 75.44 111.137 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.65 92.04 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.822 0.737 . . . . 71.43 111.698 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.3 t -56.62 -30.97 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.978 1.311 . . . . 74.21 110.503 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.6 mt -68.19 -45.91 72.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.426 1.49 . . . . 75.51 110.791 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -54.37 -42.62 70.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.247 -0.649 . . . . 75.31 109.247 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -76.91 0.88 19.31 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.738 1.014 . . . . 75.02 113.738 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -110.39 -41.16 4.44 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.786 1.635 . . . . 74.14 111.402 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -28.47 68.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 120.432 -1.417 . . . . 72.2 111.029 175.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -82.59 1.75 36.57 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 118.625 -0.702 . . . . 75.1 112.716 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.5 m -92.45 -176.11 4.21 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 120.341 1.428 . . . . 71.24 111.105 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.99 79.88 1.93 Allowed 'General case' 0 C--O 1.24 0.566 0 C-N-CA 126.024 1.73 . . . . 62.4 109.246 -170.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.533 ' CD2' ' H ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -86.1 -6.43 59.02 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.038 -1.664 . . . . 72.44 113.309 -162.813 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.1 -62.3 1.54 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.585 1.954 . . . . 62.54 111.651 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -86.31 2.04 48.8 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.551 0.74 . . . . 72.14 112.462 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.95 151.58 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.259 -0.901 . . . . 74.12 109.504 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -83.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.414 1.886 . . . . 71.04 108.868 174.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -98.33 117.74 33.41 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 74.44 107.569 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.3 mmtm -56.6 -39.25 73.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.03 0.832 . . . . 70.31 110.859 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -47.38 74.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.631 1.172 . . . . 74.3 110.446 -174.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.29 -23.67 67.09 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.431 -0.507 . . . . 70.14 111.71 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -64.34 -55.49 20.81 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 107.873 -1.158 . . . . 65.4 107.873 173.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.98 -50.68 63.65 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.24 1.816 . . . . 73.01 110.559 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.61 -22.01 66.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.113 -0.494 . . . . 74.4 111.835 -177.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.43 -52.09 42.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.214 -1.154 . . . . 74.02 110.214 172.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.4 t -55.3 -46.4 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 123.735 0.814 . . . . 74.01 109.033 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 46.4 mtt -55.37 -41.62 72.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.077 0.769 . . . . 73.42 113.077 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.29 -46.83 85.37 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.932 0.787 . . . . 72.23 109.238 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -57.8 -56.14 25.84 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.065 0.546 . . . . 75.12 109.944 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -55.39 -43.58 75.32 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.976 0.807 . . . . 75.03 111.527 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -3.22 37.17 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.93 -1.106 . . . . 75.04 113.847 -177.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.242 0 C-N-CA 126.0 1.72 . . . . 73.23 107.714 171.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.469 ' HA3' ' OD2' ' A' ' 22' ' ' ASP . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 109.691 -1.364 . . . . 73.24 109.691 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -137.97 -168.55 2.37 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.04 0.536 . . . . 73.12 110.012 -163.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -57.21 -29.27 63.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.057 0.943 . . . . 74.23 112.616 -177.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -66.86 -37.4 84.37 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 123.424 0.69 . . . . 74.33 109.3 -165.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -46.35 -59.86 2.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.577 0.751 . . . . 72.03 111.132 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -60.91 -45.93 92.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.976 -0.535 . . . . 73.45 112.228 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -68.34 -26.58 65.68 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.385 0.993 . . . . 74.43 110.824 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -35.22 77.3 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 119.857 -1.777 . . . . 73.14 110.339 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.28 -20.39 66.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.529 1.059 . . . . 71.34 111.536 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.06 -17.83 21.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.408 0.683 . . . . 61.22 112.361 175.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.61 9.51 1.39 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.227 1.411 . . . . 71.03 112.448 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.11 17.6 71.6 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.566 1.079 . . . . 33.2 113.096 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -103.76 156.32 35.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.403 1.081 . . . . 73.32 110.684 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.16 160.03 46.19 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.051 3.167 . . . . 74.23 113.062 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -63.88 -45.7 88.19 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.717 0.807 . . . . 74.34 109.248 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -23.67 65.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.901 -1.12 . . . . 74.45 112.353 -168.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -70.66 -56.94 9.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 N-CA-C 106.726 -1.583 . . . . 63.13 106.726 168.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.01 -40.21 60.64 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.385 0.993 . . . . 71.04 113.058 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.52 -15.19 57.21 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.52 1.528 . . . . 71.21 113.667 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.3 -18.87 12.4 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.651 1.581 . . . . 73.23 112.108 173.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.2 tp -92.42 -29.65 16.17 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 126.15 1.78 . . . . 74.33 111.581 -173.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.469 ' OD2' ' HA3' ' A' ' 1' ' ' GLY . 5.9 t0 -56.97 -43.88 82.09 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 123.495 0.718 . . . . 73.41 110.416 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -34.25 66.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.902 2.081 . . . . 74.25 113.811 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.5 mm -58.85 -20.69 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 123.932 0.893 . . . . 74.33 109.289 178.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 32' ' ' HIS . 39.5 m-85 -104.67 9.53 35.12 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.676 1.59 . . . . 74.12 112.968 177.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -116.21 -32.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.593 1.557 . . . . 75.21 111.068 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.68 24.22 0.89 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.847 0.859 . . . . 74.35 111.19 -176.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.01 80.62 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.98 1.753 . . . . 74.03 113.93 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.462 HD11 ' HE3' ' A' ' 59' ' ' LYS . 2.2 mt -73.78 -63.89 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.873 1.337 . . . . 64.03 110.527 -168.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.55 158.71 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.392 1.077 . . . . 74.12 113.465 -169.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.15 13.04 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 127.732 2.413 . . . . 75.03 115.47 -172.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.493 ' HA ' ' CD1' ' A' ' 25' ' ' TYR 0.258 6.7 p-80 56.11 -21.77 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.939 2.496 . . . . 71.43 116.604 -161.452 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 23.9 5.55 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.59 1.556 . . . . 74.01 111.409 -177.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -70.15 19.13 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.617 1.967 . . . . 64.23 113.766 -175.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.8 mt -129.22 -171.83 2.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.439 1.496 . . . . 73.32 110.701 -152.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.91 169.74 17.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 126.969 2.107 . . . . 74.0 107.806 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -47.28 -46.03 24.47 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 126.537 1.935 . . . . 73.5 112.423 -169.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -54.97 -29.32 56.62 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.746 0.647 . . . . 74.33 112.746 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.63 -47.81 65.67 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 118.828 -0.606 . . . . 74.04 110.605 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.513 HD11 ' H ' ' A' ' 40' ' ' ILE . 3.6 mp -71.19 -43.46 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 119.024 0.829 . . . . 74.03 109.707 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -67.87 -48.09 67.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 119.129 -0.462 . . . . 62.12 110.456 -173.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -22.5 64.11 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.014 0.825 . . . . 73.34 111.985 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.05 -37.5 77.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.575 1.08 . . . . 74.1 111.847 166.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm -65.82 -25.63 67.31 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.803 0.729 . . . . 74.34 111.544 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -87.77 21.75 2.52 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.422 -0.799 . . . . 70.21 111.976 -167.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -125.37 156.93 37.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.924 -1.11 . . . . 63.32 109.95 175.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -67.94 169.71 9.46 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.702 -0.681 . . . . 71.23 109.534 155.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -50.27 -58.86 4.7 Favored 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 125.727 1.611 . . . . 73.51 109.603 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -4.04 35.03 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.317 1.047 . . . . 65.21 112.26 -174.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -86.12 -57.09 2.18 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 109.055 -1.618 . . . . 74.1 109.055 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.99 89.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.94 1.296 . . . . 73.32 112.233 -175.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.74 -44.29 93.85 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 119.18 0.9 . . . . 73.34 110.572 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.65 -43.89 93.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 120.571 -0.451 . . . . 63.5 111.226 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 61.1 t -54.34 -41.11 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.285 -0.884 . . . . 71.13 110.264 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.54 -52.22 58.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.4 -0.593 . . . . 74.3 109.4 -178.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -58.18 -33.67 69.5 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 123.759 0.662 . . . . 75.12 109.609 -174.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -91.87 -27.77 17.73 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.69 0.677 . . . . 72.53 111.745 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -62.08 -20.96 64.56 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.469 0.652 . . . . 73.2 110.971 164.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.462 ' HE3' HD11 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -102.57 -19.47 14.84 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 113.594 0.961 . . . . 75.0 113.594 176.322 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -80.5 59.99 3.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.059 1.744 . . . . 60.51 107.003 158.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.1 m -158.1 163.72 37.35 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.526 1.531 . . . . 71.1 107.708 170.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -105.92 128.91 54.09 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 105.137 -2.171 . . . . 74.51 105.137 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.0 mt -116.35 44.83 1.9 Allowed 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.701 2.4 . . . . 75.22 109.004 -172.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.3 m -59.08 95.58 0.03 OUTLIER 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.726 0.81 . . . . 75.42 111.395 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 49.14 35.05 6.56 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 128.309 2.643 . . . . 75.44 113.485 177.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -60.02 111.53 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.682 -1.229 . . . . 74.54 107.682 169.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -67.23 -40.12 86.31 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.705 -1.247 . . . . 63.34 109.762 168.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -78.32 50.45 0.93 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.201 1.4 . . . . 60.11 112.514 -170.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -52.71 -39.93 62.49 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 120.946 -1.096 . . . . 74.44 112.196 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.7 p -66.13 -53.35 38.91 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.325 1.05 . . . . 72.53 110.14 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -38.45 84.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.1 -0.476 . . . . 74.13 110.723 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -62.58 -49.55 74.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 108.93 -0.767 . . . . 75.21 108.93 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.68 -50.61 70.46 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.89 0.876 . . . . 73.34 109.795 -177.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.405 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 4.5 t -64.93 -21.82 66.89 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.106 0.962 . . . . 70.13 110.943 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.37 -53.46 13.29 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 126.063 1.792 . . . . 71.51 110.795 169.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -55.81 -47.93 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.736 1.268 . . . . 73.23 108.652 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.405 ' SD ' ' HA ' ' A' ' 74' ' ' CYS . 44.7 mtt -48.05 -56.9 6.63 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.95 0.9 . . . . 72.22 110.839 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -59.13 -43.53 92.0 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.882 -0.784 . . . . 73.23 108.882 -175.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -60.99 -35.34 76.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 119.244 -0.408 . . . . 73.32 111.647 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -65.83 -42.53 90.41 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.558 -1.339 . . . . 73.24 112.71 175.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -79.35 -15.91 57.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 118.407 -0.806 . . . . 73.33 113.108 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 . . . . . 0 N--CA 1.45 -0.451 0 C-N-CA 126.535 1.934 . . . . 73.51 107.327 -174.073 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.445 0 N-CA-C 110.19 -1.164 . . . . 62.21 110.19 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.48 -173.41 2.52 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.743 1.217 . . . . 63.24 111.684 -169.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -44.18 -45.04 8.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.162 2.185 . . . . 73.14 110.899 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.73 -34.44 78.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.632 1.173 . . . . 75.31 110.649 -170.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.62 -50.04 69.05 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.17 0.988 . . . . 74.42 112.133 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.97 -40.59 91.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.082 -0.485 . . . . 73.52 111.253 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.3 m -61.65 -45.51 93.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.788 0.435 . . . . 72.42 110.294 175.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.3 mt -61.4 -43.15 99.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.493 0.717 . . . . 74.33 111.993 -176.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.4 mt -57.77 -40.33 79.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.587 -0.523 . . . . 64.51 109.587 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -82.09 -20.27 38.5 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.646 0.26 . . . . 74.11 111.26 -172.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.41 18.91 0.14 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.643 2.777 . . . . 75.21 111.895 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 89.18 -0.43 81.52 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 125.157 1.36 . . . . 74.51 114.115 168.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 90.8 mt -77.08 147.93 77.59 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.863 1.332 . . . . 65.12 111.107 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.32 156.93 60.54 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.152 1.901 . . . . 64.34 109.441 165.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.47 -42.93 97.24 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 124.127 0.971 . . . . 71.11 108.909 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.1 -37.15 74.0 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 118.608 -0.71 . . . . 72.31 111.602 -174.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.1 t -78.58 -47.27 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.446 1.098 . . . . 73.13 108.287 -179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.16 70.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.173 0.589 . . . . 71.22 111.578 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.41 -55.35 22.33 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.881 1.273 . . . . 74.33 110.98 178.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -45.25 83.53 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.022 0.529 . . . . 74.13 110.101 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.09 -36.08 81.2 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.095 0.558 . . . . 74.42 111.685 -167.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.61 -45.59 73.68 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.486 1.115 . . . . 74.13 110.521 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.84 -19.75 65.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 114.26 1.208 . . . . 73.32 114.26 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mt -72.11 -27.91 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 108.746 -0.835 . . . . 71.32 108.746 177.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.65 -23.12 24.34 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.649 1.18 . . . . 75.13 111.656 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.9 t -73.14 -33.56 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 123.624 0.77 . . . . 75.11 111.262 177.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.44 17.59 15.77 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.509 0.929 . . . . 71.53 113.509 -164.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.21 33.41 78.17 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 123.781 0.705 . . . . 75.45 114.343 170.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -94.48 -75.03 0.52 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 127.295 2.238 . . . . 74.24 108.883 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 17.6 m -123.32 163.66 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.64 1.176 . . . . 74.53 110.057 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.86 160.73 25.96 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.901 0.481 . . . . 74.35 110.492 167.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.67 -28.08 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.566 -0.709 . . . . 62.41 110.169 166.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.2 p -81.69 -1.05 45.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.098 0.959 . . . . 74.34 112.272 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.47 -13.24 61.39 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.354 -0.841 . . . . 75.32 112.95 -171.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.35 156.99 21.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.624 1.169 . . . . 71.54 111.246 -174.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -91.35 163.21 14.29 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.398 1.079 . . . . 42.31 108.186 164.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -61.87 -28.35 69.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.764 0.426 . . . . 51.35 110.589 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -62.63 -29.92 70.98 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.795 -1.191 . . . . 74.11 111.059 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.87 -47.09 49.07 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.644 -0.693 . . . . 64.31 109.824 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.0 mm -57.22 -38.69 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.587 0.63 . . . . 73.42 110.224 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.44 -54.44 8.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.101 0.56 . . . . 73.33 110.573 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.2 64.65 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.26 0.467 . . . . 72.54 112.26 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 mt -63.11 -42.9 99.66 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.757 1.223 . . . . 74.43 111.714 171.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.52 -24.34 62.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.767 1.167 . . . . 63.15 110.957 173.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -76.84 34.6 0.15 Allowed 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.155 -0.966 . . . . 64.21 111.503 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -134.49 151.93 51.46 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.286 1.034 . . . . 74.13 108.403 165.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -78.86 176.73 9.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.191 0.52 . . . . 64.53 109.784 161.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -61.3 2.51 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 125.863 1.665 . . . . 73.25 111.32 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -67.07 -24.48 65.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.081 0.552 . . . . 55.03 111.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.52 -69.64 1.22 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 109.331 -1.508 . . . . 62.24 109.331 170.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.43 -41.27 76.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.26 1.424 . . . . 65.25 111.503 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.9 mt -62.03 -39.4 92.19 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 118.37 -0.824 . . . . 75.42 111.501 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.29 84.42 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.572 0.624 . . . . 75.22 110.012 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 t -55.4 -40.68 58.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.371 0.532 . . . . 73.52 110.569 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.26 -45.72 69.03 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.623 0.769 . . . . 64.11 109.794 -176.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -58.49 -51.73 68.64 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.885 0.741 . . . . 73.23 109.462 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -69.57 -30.68 68.52 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.531 0.605 . . . . 72.33 111.407 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -67.13 -39.82 86.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.865 1.266 . . . . 74.33 111.266 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -43.71 78.25 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.493 -0.754 . . . . 63.52 110.083 171.506 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -76.96 46.49 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.497 1.919 . . . . 64.53 110.212 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.96 -174.77 3.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.923 2.089 . . . . 71.32 107.686 170.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -120.02 112.27 18.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.628 1.171 . . . . 65.13 108.565 176.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.0 mt -95.59 30.2 2.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.297 1.439 . . . . 73.41 110.295 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.95 -69.89 0.34 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.933 -1.136 . . . . 74.12 107.933 163.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -80.19 39.22 0.44 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.27 1.428 . . . . 73.42 113.083 -173.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -106.91 165.17 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.128 0.971 . . . . 55.01 108.83 170.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.68 -70.52 0.33 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.99 1.316 . . . . 74.44 108.9 170.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -56.99 75.8 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 128.993 2.917 . . . . 75.44 111.204 159.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -51.24 -32.04 22.89 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.262 -0.899 . . . . 74.12 111.644 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.8 p -65.47 -56.84 10.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 118.587 0.63 . . . . 64.55 109.977 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.67 -33.97 68.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.257 0.623 . . . . 73.11 111.436 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -60.82 -53.08 61.67 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.299 0.571 . . . . 72.23 109.945 176.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.1 tp -62.46 -42.45 99.47 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-O 121.445 0.641 . . . . 65.22 110.025 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.42 -37.75 68.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.79 1.636 . . . . 72.51 110.379 176.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.66 -57.4 17.91 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 124.966 1.27 . . . . 74.42 110.462 174.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.44 -47.86 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 117.804 0.802 . . . . 72.42 109.366 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.4 mtt -52.78 -46.74 67.74 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.985 0.914 . . . . 72.24 112.165 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -57.8 -49.92 75.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 118.796 0.725 . . . . 75.53 109.52 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -43.42 54.7 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.465 0.706 . . . . 75.51 111.647 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -71.8 -38.12 70.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.166 1.172 . . . . 72.31 114.166 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -73.66 -21.87 60.14 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.97 1.259 . . . . 74.44 111.786 172.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -101.03 69.37 1.3 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.399 1.08 . . . . 61.34 108.609 -177.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 -128.33 68.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.496 1.119 . . . . 71.41 108.461 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -124.16 123.58 40.61 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 106.725 -1.583 . . . . 74.42 106.725 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.2 tptp . . . . . 0 C--O 1.25 1.118 0 N-CA-C 108.761 -0.829 . . . . 75.15 108.761 -170.878 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 109.801 -1.32 . . . . 72.54 109.801 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t -129.34 -175.05 3.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.518 1.127 . . . . 70.1 110.453 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.19 -17.6 64.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 126.649 1.98 . . . . 74.31 113.924 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -67.95 -36.94 80.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.136 0.88 . . . . 65.2 109.09 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -46.51 -53.35 11.46 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 125.897 1.679 . . . . 62.24 112.577 -177.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.45 -47.26 86.15 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.769 0.428 . . . . 45.2 111.552 -175.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.7 m -67.93 -35.59 78.69 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.042 -0.355 . . . . 74.12 110.042 -176.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.7 -34.96 60.43 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.38 -0.825 . . . . 73.34 112.067 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 17.3 mt -54.54 -36.23 64.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.32 0.648 . . . . 72.43 110.063 166.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -83.46 -21.07 32.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.669 0.788 . . . . 74.43 111.705 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 1.51 6.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.519 1.928 . . . . 73.43 112.236 174.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.47 0.79 46.9 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.683 1.135 . . . . 74.14 113.28 174.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.7 mt -84.94 144.72 42.19 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 118.241 1.02 . . . . 74.2 109.636 -169.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.91 156.04 56.62 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.922 1.748 . . . . 72.33 110.285 173.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -59.32 -45.7 90.59 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 124.951 1.3 . . . . 62.11 108.698 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -39.59 86.95 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.366 0.416 . . . . 74.33 111.098 -172.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.72 -58.78 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.681 1.592 . . . . 74.41 107.994 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.47 -44.99 46.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.448 1.099 . . . . 73.21 112.532 -174.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -58.6 -41.76 86.58 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.458 1.026 . . . . 53.12 111.467 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.61 -39.55 64.49 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.809 -0.557 . . . . 74.33 110.739 177.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.9 tp -69.76 -39.64 76.57 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.852 1.261 . . . . 74.41 110.811 -169.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -53.85 -47.1 71.32 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.952 1.301 . . . . 74.11 110.819 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.76 -24.78 58.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.77 1.628 . . . . 65.55 113.468 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -75.07 -25.09 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.128 -0.983 . . . . 72.25 109.183 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -89.43 -10.4 46.58 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.885 1.674 . . . . 72.35 112.706 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.8 t -84.79 -32.84 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 124.406 1.082 . . . . 74.52 111.975 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.73 13.86 16.97 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.91 0.777 . . . . 73.34 112.985 -168.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 61.55 31.44 77.68 Favored Glycine 0 CA--C 1.53 1.004 0 O-C-N 121.617 -0.677 . . . . 54.44 112.4 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.467 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 22.1 mt -83.54 -65.02 1.06 Allowed 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 126.799 2.04 . . . . 71.13 108.282 175.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.8 m -128.69 156.83 41.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 123.157 0.583 . . . . 74.41 109.894 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.48 154.65 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.267 0.627 . . . . 50.25 110.192 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.2 p80 -62.42 -15.1 47.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 118.729 -0.653 . . . . 73.25 112.547 175.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.8 p -120.22 22.25 11.45 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.217 1.807 . . . . 74.11 112.319 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -84.94 -3.49 58.76 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 123.265 1.507 . . . . 73.24 112.713 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -94.53 -172.86 2.87 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 126.334 1.854 . . . . 71.32 109.47 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -127.21 175.59 8.04 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.366 0.666 . . . . 74.42 111.584 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -63.69 -32.69 74.26 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.563 0.745 . . . . 75.23 111.282 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.1 mtp180 -61.83 -37.29 83.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.497 0.719 . . . . 75.31 109.947 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.17 93.94 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.651 0.78 . . . . 71.15 110.867 175.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.62 -50.92 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.954 0.797 . . . . 64.04 109.965 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -62.11 -51.25 68.67 Favored 'General case' 0 C--O 1.23 0.059 0 N-CA-C 109.875 -0.417 . . . . 71.22 109.875 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.47 69.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.164 -0.922 . . . . 74.41 112.299 -176.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.07 -51.73 67.91 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.955 0.798 . . . . 74.55 110.661 169.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.11 -39.99 83.97 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.003 0.82 . . . . 74.32 111.487 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -77.12 38.45 0.22 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-N 119.285 0.948 . . . . 74.54 112.473 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -129.1 146.75 50.97 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.335 -1.357 . . . . 72.33 107.335 161.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -68.49 170.3 9.31 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.826 0.346 . . . . 74.22 110.483 163.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -47.53 -64.17 0.86 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 127.38 2.272 . . . . 73.44 110.786 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -31.12 71.84 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 123.365 0.666 . . . . 74.43 110.871 -172.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.84 -53.95 10.56 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 110.319 -1.112 . . . . 72.51 110.319 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.5 -37.63 75.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.8 1.24 . . . . 70.24 111.599 177.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.98 -43.32 95.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 119.447 1.021 . . . . 65.55 110.937 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -61.74 -45.07 95.53 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.992 0.901 . . . . 61.42 110.785 178.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.23 -37.5 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.939 0.896 . . . . 51.22 110.315 176.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.03 -48.6 20.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 119.057 0.844 . . . . 70.53 110.994 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -57.5 -41.74 81.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.592 -0.892 . . . . 72.34 108.592 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -82.65 -10.07 59.1 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 112.866 0.691 . . . . 74.35 112.866 -176.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -67.18 -61.03 2.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.805 -0.813 . . . . 74.52 108.805 166.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.467 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -65.74 -39.73 91.39 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 118.697 -0.668 . . . . 70.44 110.453 -178.9 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -82.73 54.63 2.74 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.289 1.436 . . . . 64.41 110.145 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.97 -172.75 4.13 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.853 2.061 . . . . 74.24 107.999 173.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -129.51 114.69 16.42 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.212 1.405 . . . . 74.24 108.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.97 24.39 7.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.651 2.38 . . . . 70.32 110.8 -176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.6 t -70.5 -22.64 62.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.05 1.34 . . . . 62.32 112.512 -177.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -125.41 12.6 8.14 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.509 1.123 . . . . 73.35 112.301 -171.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.2 p -90.84 140.42 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.883 0.765 . . . . 74.14 109.314 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -36.2 23.09 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 122.287 -0.258 . . . . 72.15 111.183 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -137.9 118.56 14.01 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.424 1.49 . . . . 75.12 107.303 -163.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -64.4 -39.14 93.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.171 0.804 . . . . 74.54 113.171 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -40.33 94.41 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 124.884 1.274 . . . . 72.14 107.677 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.16 -19.3 65.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.857 0.753 . . . . 53.14 112.61 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -79.3 -51.24 9.7 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 122.15 0.976 . . . . 73.44 108.591 173.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.73 -47.27 86.31 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.203 -1.362 . . . . 74.22 108.408 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.6 p -59.91 -26.69 66.12 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.768 1.627 . . . . 72.24 110.411 -176.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.2 -53.05 5.36 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.154 -0.779 . . . . 74.35 111.154 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.9 t -57.23 -40.58 74.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 117.375 0.587 . . . . 71.24 110.031 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.0 mtt -55.48 -45.08 77.01 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 121.358 -0.839 . . . . 62.31 111.073 175.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -63.5 -54.75 31.43 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 108.908 -0.775 . . . . 74.22 108.908 -171.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.3 t -63.83 -36.81 85.13 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.889 -0.577 . . . . 74.42 110.543 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 -58.26 -44.73 88.52 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 120.14 1.336 . . . . 74.33 113.36 174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.04 -11.51 59.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.253 0.479 . . . . 74.42 111.487 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -130.43 75.14 1.64 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.244 1.418 . . . . 71.12 109.155 177.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -122.68 0.4 9.29 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.789 1.236 . . . . 72.53 114.11 -176.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.62 160.1 23.33 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.169 -1.048 . . . . 74.54 108.169 157.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.255 1.371 0 N-CA-C 105.939 -1.875 . . . . 73.11 105.939 159.561 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.396 0 N-CA-C 111.442 -0.663 . . . . 65.51 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.43 -172.83 3.0 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.921 1.688 . . . . 74.33 110.579 -177.647 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -45.15 -44.15 10.47 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.483 2.313 . . . . 71.51 110.343 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.76 -39.14 80.11 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.461 1.104 . . . . 74.52 110.317 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -53.12 -57.96 8.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.269 1.027 . . . . 74.44 111.204 -175.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -65.04 -39.05 92.77 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.25 -0.58 . . . . 73.35 110.554 -175.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.6 m -65.8 -36.79 84.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.168 0.44 . . . . 73.42 110.122 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.13 -37.18 86.2 Favored 'General case' 0 C--N 1.34 0.179 0 O-C-N 120.816 -1.177 . . . . 70.45 111.105 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -65.52 -18.58 65.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 119.13 -0.462 . . . . 72.42 111.79 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.74 -14.16 21.0 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.778 0.831 . . . . 65.04 111.511 173.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.23 -0.34 14.1 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.033 1.733 . . . . 74.04 112.382 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.29 14.91 24.82 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.716 -1.047 . . . . 64.21 113.304 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.8 mt -113.12 152.44 45.03 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 118.927 1.364 . . . . 74.54 111.815 -166.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.3 160.41 48.89 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.005 2.47 . . . . 72.1 110.911 172.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 14.7 tt0 -64.43 -46.0 85.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.252 -1.018 . . . . 64.52 108.252 178.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.79 -38.11 74.92 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.568 0.951 . . . . 75.12 113.568 -170.779 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.7 t -78.63 -43.05 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.605 -1.257 . . . . 74.4 107.605 178.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.3 -32.32 56.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.968 0.804 . . . . 70.32 111.927 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.02 -23.25 65.27 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 114.367 1.247 . . . . 74.51 114.367 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.84 -6.14 20.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 118.947 0.794 . . . . 74.12 111.92 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 tt -104.66 -27.96 11.51 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 124.762 1.225 . . . . 74.55 111.59 -167.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.04 -41.86 88.86 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.314 0.961 . . . . 53.23 111.484 173.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.96 -24.24 51.61 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.232 1.413 . . . . 74.32 114.002 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.0 mt -73.25 -18.12 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.801 0.841 . . . . 73.25 109.436 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -99.79 -27.77 13.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.445 1.498 . . . . 74.11 112.651 175.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.3 t -58.87 -51.06 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-O 118.996 -0.526 . . . . 71.55 110.496 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.08 0.88 46.61 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.93 1.085 . . . . 74.34 113.93 -162.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 44.34 87.96 Favored Glycine 0 CA--C 1.529 0.92 0 O-C-N 121.245 -0.909 . . . . 72.53 112.016 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.429 HD11 ' HE3' ' A' ' 59' ' ' LYS . 1.4 mt -82.09 -74.59 0.34 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 126.552 1.941 . . . . 74.24 107.035 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 m -103.34 146.84 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 N-CA-C 113.83 1.048 . . . . 65.44 113.83 172.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.17 26.89 0.06 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 129.003 2.921 . . . . 74.14 116.46 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . 0.303 2.9 p80 55.46 -21.24 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.828 2.851 . . . . 70.34 116.75 -165.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.1 p -129.14 16.55 6.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.447 1.476 . . . . 71.13 112.118 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.73 -15.41 58.46 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.299 1.44 . . . . 70.12 113.709 -173.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.14 170.41 10.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.619 1.568 . . . . 74.05 111.601 -160.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -105.45 158.51 16.61 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.831 -0.803 . . . . 64.12 108.831 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -47.59 -46.86 28.67 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.769 2.028 . . . . 64.41 110.45 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -59.16 -35.19 73.09 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 122.987 0.515 . . . . 72.41 111.973 -176.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.88 62.38 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.442 -0.79 . . . . 73.02 110.291 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 6.9 mm -71.79 -41.12 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 74.15 110.135 175.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.64 -58.59 6.46 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.867 -0.79 . . . . 73.1 108.867 175.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.85 -40.2 63.19 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.245 1.018 . . . . 70.32 111.471 -174.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.2 mt -46.99 -54.09 10.94 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 124.424 1.09 . . . . 73.43 111.541 173.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -28.6 69.22 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.462 0.574 . . . . 72.22 111.773 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -73.25 -16.22 61.4 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.479 -0.763 . . . . 65.03 112.441 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -85.93 137.44 32.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.567 1.147 . . . . 74.53 110.937 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.36 166.01 3.28 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 113.341 -1.754 . . . . 72.32 110.677 156.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.14 -58.16 9.12 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 113.946 -1.479 . . . . 72.22 110.553 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.03 -30.95 70.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.874 0.369 . . . . 75.52 111.406 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.26 -66.98 2.44 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 108.564 -1.814 . . . . 70.22 108.564 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.5 -42.0 70.26 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.986 0.735 . . . . 64.23 112.986 -177.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.14 -41.61 88.72 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.763 0.825 . . . . 72.54 111.405 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -73.1 -42.51 62.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.361 0.264 . . . . 63.42 110.812 176.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 70.0 t -54.28 -29.85 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.442 1.497 . . . . 71.21 110.27 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.7 mt -77.48 -54.52 6.32 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.36 1.064 . . . . 74.31 109.013 179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -56.76 -51.09 70.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 123.634 0.584 . . . . 72.43 109.869 -175.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -72.29 -7.5 49.8 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.267 0.84 . . . . 74.33 113.267 -172.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -93.64 -58.41 2.28 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 125.833 1.653 . . . . 74.25 110.216 174.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' HE3' HD11 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -58.05 -33.37 68.93 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.591 1.156 . . . . 73.11 110.885 178.159 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -76.77 52.33 0.83 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.247 1.819 . . . . 61.55 109.977 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m -154.73 171.56 19.35 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 120.23 -1.544 . . . . 71.11 109.814 168.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -110.68 96.98 6.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.084 1.354 . . . . 64.45 107.673 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.5 mt -89.65 -6.25 56.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 118.1 -0.952 . . . . 72.23 112.782 -164.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.84 -56.06 5.85 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 73.31 111.722 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -101.2 9.93 41.35 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.42 0.688 . . . . 74.32 112.415 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.6 t -73.5 104.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 106.803 -1.555 . . . . 72.43 106.803 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -62.67 -28.04 69.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.326 1.05 . . . . 72.41 113.251 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -129.15 96.15 4.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.996 0.918 . . . . 73.12 108.639 177.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -54.27 -33.83 59.48 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.218 1.007 . . . . 73.43 109.999 172.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 m -69.66 -51.04 38.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.789 1.635 . . . . 74.25 111.39 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.18 74.45 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.15 0.432 . . . . 74.22 110.393 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -64.73 -51.8 60.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.02 -0.733 . . . . 72.23 109.02 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.3 tp -67.62 -58.09 5.3 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.628 1.171 . . . . 73.42 110.205 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -22.54 66.94 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.601 -0.727 . . . . 74.12 110.983 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.42 -48.44 14.03 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.193 -0.782 . . . . 54.31 111.35 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.0 t -55.31 -45.19 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 118.453 1.126 . . . . 74.15 109.678 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.1 mtt -50.78 -51.41 50.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.471 0.578 . . . . 74.21 111.147 171.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -49.09 73.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.826 -0.607 . . . . 73.23 110.357 -174.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -46.47 89.46 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.379 0.536 . . . . 70.12 110.8 175.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -54.28 -52.63 60.82 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.76 0.709 . . . . 73.52 111.84 -175.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -67.92 -9.33 44.26 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.132 0.573 . . . . 71.14 111.493 -177.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -135.19 62.26 1.64 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.379 1.872 . . . . 74.21 110.573 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -80.45 53.81 1.91 Allowed 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.702 -1.249 . . . . 74.5 109.616 166.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -89.82 -175.64 4.69 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.011 -1.107 . . . . 74.4 108.011 150.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm . . . . . 0 CA--C 1.497 -1.078 0 N-CA-C 105.343 -2.095 . . . . 74.01 105.343 -169.767 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.484 0 N-CA-C 109.563 -1.415 . . . . 43.44 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 t -101.83 -178.39 3.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.461 0.648 . . . . 71.54 110.734 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.91 -24.35 66.9 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.175 -0.466 . . . . 72.31 111.499 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.44 -40.84 83.66 Favored 'General case' 0 C--N 1.346 0.423 0 N-CA-C 109.022 -0.733 . . . . 71.25 109.022 -176.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -45.16 -53.44 8.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.853 1.261 . . . . 73.42 112.545 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -65.47 -41.6 93.16 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.224 -0.417 . . . . 72.43 111.602 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -65.66 -31.43 72.44 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.475 0.71 . . . . 71.32 110.769 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.53 -40.55 76.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.884 -1.135 . . . . 70.45 110.268 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.14 -23.47 66.59 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.984 0.811 . . . . 73.32 111.579 176.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.82 -18.87 38.95 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.508 0.594 . . . . 54.35 111.647 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.38 -0.46 29.16 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.972 -1.08 . . . . 72.4 112.754 -161.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 7.09 45.67 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.429 1.014 . . . . 64.41 111.964 -171.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.0 144.92 28.66 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 118.504 1.152 . . . . 74.13 110.04 -172.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.72 163.21 38.02 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.117 1.878 . . . . 62.23 110.228 167.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -57.7 -48.12 80.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.312 -0.996 . . . . 73.44 108.312 177.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.46 -31.45 70.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 112.896 0.702 . . . . 75.21 112.896 -169.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.15 -51.5 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.288 1.435 . . . . 71.5 108.591 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -38.65 71.84 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.427 0.691 . . . . 73.53 111.98 -177.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.0 -48.1 52.64 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.804 1.642 . . . . 75.31 110.966 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.29 31.58 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 124.563 1.145 . . . . 75.13 110.465 -175.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.37 -42.83 87.44 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 119.419 1.008 . . . . 62.1 111.376 177.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -51.02 -41.52 59.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.337 1.055 . . . . 64.52 111.328 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -53.29 -36.62 61.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 127.594 2.358 . . . . 75.2 112.712 177.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.4 mt -74.5 -14.07 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.093 0.957 . . . . 65.42 108.64 -174.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -100.58 -8.95 22.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.792 1.637 . . . . 74.51 112.086 178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 84.5 t -78.55 -34.5 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 125.496 1.518 . . . . 74.3 111.265 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 -3.89 58.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.235 1.198 . . . . 73.33 114.235 -161.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 63.97 28.9 73.45 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 121.363 -0.836 . . . . 74.44 111.46 -163.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 mt -71.36 -81.94 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 128.253 2.621 . . . . 74.51 105.783 162.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.0 m -124.71 176.79 5.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 123.724 0.81 . . . . 71.12 111.48 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.37 155.25 20.21 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 125.184 1.393 . . . . 74.34 108.044 166.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -48.77 -32.32 8.41 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.605 1.562 . . . . 72.13 112.343 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.07 5.88 31.55 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.998 2.119 . . . . 71.1 113.47 -175.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.82 -15.21 63.44 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 119.276 -2.14 . . . . 73.53 114.522 -177.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.6 mt -95.89 136.94 35.66 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.753 0.821 . . . . 74.33 111.729 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.79 155.33 40.92 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.136 -1.431 . . . . 73.42 107.136 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.12 -32.6 71.16 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.787 -0.57 . . . . 74.11 110.961 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -61.89 -29.63 70.33 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.684 0.794 . . . . 73.14 112.773 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.97 -35.87 31.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.644 -0.502 . . . . 73.34 109.644 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mm -60.86 -43.26 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.657 0.662 . . . . 73.4 109.28 172.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.24 -55.85 24.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.431 1.092 . . . . 73.31 110.244 171.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.97 -37.76 74.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 119.224 -0.417 . . . . 73.12 111.743 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -42.28 78.81 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.479 0.712 . . . . 74.24 111.596 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -25.89 67.08 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.627 0.648 . . . . 74.51 112.585 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -75.87 -13.28 60.27 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 120.007 1.276 . . . . 72.4 113.118 -173.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -90.69 135.53 33.65 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.514 1.526 . . . . 73.32 108.714 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -65.97 170.01 6.06 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.278 -0.873 . . . . 71.44 110.595 163.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -46.78 -64.39 0.78 Allowed 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 126.997 2.119 . . . . 73.42 111.52 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -64.15 -36.69 84.85 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.009 0.524 . . . . 74.23 111.817 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -64.87 -46.36 89.72 Favored Glycine 0 C--N 1.34 0.797 0 N-CA-C 110.617 -0.993 . . . . 71.41 110.617 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.56 82.01 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.932 1.693 . . . . 73.51 110.395 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 48.0 mt -55.19 -45.63 75.81 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.713 0.688 . . . . 75.43 110.362 177.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.15 82.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.74 0.274 . . . . 73.53 111.74 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 41.9 t -56.64 -41.94 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.29 1.036 . . . . 74.5 110.564 175.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.15 -43.29 78.61 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.668 -0.645 . . . . 74.41 110.213 -174.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -62.93 -39.81 95.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.384 -0.969 . . . . 71.23 108.384 -176.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -74.19 -31.14 62.54 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 118.273 0.488 . . . . 75.4 111.231 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.71 -57.99 10.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.916 0.486 . . . . 74.41 109.892 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -21.97 66.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.336 -0.84 . . . . 74.43 112.105 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -74.99 49.01 0.41 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.42 1.009 . . . . 72.5 109.564 164.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.7 m -152.52 150.05 29.17 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.362 1.465 . . . . 71.43 111.566 172.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -97.58 87.21 4.02 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 122.946 1.355 . . . . 71.3 109.617 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 mt -76.76 46.33 0.45 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.619 1.968 . . . . 73.11 111.378 -172.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.8 m -95.04 -5.46 44.38 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.526 1.531 . . . . 71.13 112.607 167.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -125.72 41.2 3.57 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.498 -1.376 . . . . 70.11 111.463 -175.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.69 100.58 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 124.899 1.279 . . . . 74.33 109.959 -168.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.573 ' H ' ' NE2' ' A' ' 67' ' ' GLN . 1.3 pm0 -65.69 -47.07 76.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.32 1.048 . . . . 74.13 112.599 176.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -107.43 99.03 8.57 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 106.589 -1.634 . . . . 70.3 106.589 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -60.35 -34.72 74.24 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.079 0.466 . . . . 74.42 109.964 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 72.5 p -64.71 -55.53 19.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.634 1.174 . . . . 65.5 110.659 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.88 -26.73 67.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 119.081 -0.485 . . . . 73.24 112.028 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -63.31 -54.34 38.55 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.696 0.68 . . . . 72.23 109.866 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.72 -52.88 63.8 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.967 0.907 . . . . 74.4 109.613 -178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.11 -29.29 65.38 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 115.749 -0.66 . . . . 74.13 112.194 176.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.61 -39.15 90.71 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.708 1.147 . . . . 71.52 112.263 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 94.9 t -64.67 -48.52 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 107.67 -1.233 . . . . 74.43 107.67 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtp -58.52 -33.14 69.52 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.011 -1.056 . . . . 71.4 112.297 178.146 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -58.05 -58.15 9.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.84 -0.8 . . . . 74.41 108.84 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.9 t -62.49 -50.1 72.73 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.934 -0.555 . . . . 74.12 110.157 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -49.14 -28.66 4.51 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 117.475 2.398 . . . . 74.12 117.475 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -115.28 0.24 13.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.337 0.971 . . . . 74.5 112.659 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -127.68 74.61 1.54 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.738 2.015 . . . . 74.34 108.799 159.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 30.3 ptt85 -124.64 7.79 8.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.961 1.304 . . . . 75.43 112.688 -177.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.63 49.87 1.73 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.878 2.471 . . . . 72.52 110.052 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm . . . . . 0 C--O 1.247 0.946 0 C-N-CA 125.538 1.535 . . . . 72.22 110.448 179.797 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.775 0 N-CA-C 110.569 -1.013 . . . . 62.32 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -127.16 -165.37 1.46 Allowed 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.985 0.914 . . . . 74.53 110.755 -173.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -55.07 -28.95 56.26 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 113.921 1.082 . . . . 73.55 113.921 -166.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -34.65 78.54 Favored 'General case' 0 N--CA 1.461 0.103 0 C-N-CA 123.525 0.73 . . . . 71.43 110.447 -177.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -54.79 -47.53 73.85 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.491 1.116 . . . . 74.32 110.348 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -62.26 -49.48 75.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.947 -0.549 . . . . 73.24 110.378 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -55.08 -49.55 71.4 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.425 1.09 . . . . 70.45 109.703 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.4 mt -65.8 -39.2 90.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 O-C-N 121.67 -0.644 . . . . 72.15 111.257 -177.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -64.13 -15.13 59.09 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 118.768 -0.634 . . . . 74.51 111.522 175.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.77 2.35 27.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.895 1.678 . . . . 74.23 112.711 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -96.95 24.3 6.35 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.039 1.336 . . . . 71.34 111.861 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.95 16.9 78.29 Favored Glycine 0 CA--C 1.525 0.692 0 O-C-N 121.18 -0.95 . . . . 72.35 112.979 -177.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -111.02 156.82 40.26 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 118.65 1.225 . . . . 72.51 111.371 -173.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.82 173.92 13.69 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.259 3.306 . . . . 63.44 113.917 175.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -76.68 -46.01 27.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 126.377 1.871 . . . . 73.55 111.055 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -57.37 -42.08 81.41 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 118.948 0.794 . . . . 74.01 111.34 -176.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.3 t -58.49 -63.28 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 125.017 1.327 . . . . 72.11 108.107 168.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.21 -47.27 24.44 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.161 1.385 . . . . 72.21 112.012 -171.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -53.01 -56.9 12.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.624 1.569 . . . . 74.12 110.828 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -67.4 -38.65 85.01 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.907 -0.405 . . . . 70.33 109.907 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.22 -42.65 65.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.206 1.402 . . . . 72.55 110.976 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -49.82 -50.52 44.83 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.017 1.727 . . . . 73.55 110.461 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.17 -16.3 52.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.947 1.699 . . . . 73.35 113.617 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.2 mt -73.75 -31.38 31.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 120.994 -1.066 . . . . 70.2 108.707 175.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -85.39 -48.38 9.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.882 0.873 . . . . 74.55 110.228 -177.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -53.83 -39.53 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.58 0.752 . . . . 73.23 111.758 -175.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.75 0.31 7.35 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.129 0.971 . . . . 73.22 112.888 -175.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.83 7.01 71.63 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 125.327 1.442 . . . . 63.3 112.793 174.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.458 HD13 ' HE2' ' A' ' 59' ' ' LYS . 39.8 mt -75.91 -59.8 2.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.13 0.965 . . . . 74.13 109.704 -166.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.7 167.25 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.24 1.016 . . . . 70.22 112.248 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.2 155.26 27.47 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.774 0.829 . . . . 74.51 109.779 171.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -73.8 -38.18 64.7 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.949 -0.469 . . . . 72.31 110.661 175.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.33 7.72 9.0 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.72 0.691 . . . . 72.22 112.395 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.02 -4.36 40.84 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.991 1.108 . . . . 73.13 113.991 -166.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -107.46 169.44 8.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.727 1.211 . . . . 73.41 110.325 -175.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -108.36 172.11 7.02 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.27 1.428 . . . . 74.34 109.836 -173.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.1 -44.64 64.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.037 1.335 . . . . 74.41 111.344 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -57.56 -22.84 47.12 Favored 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 125.795 1.638 . . . . 73.4 113.673 175.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.2 -36.38 34.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.939 -1.029 . . . . 74.33 110.283 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.8 mm -63.41 -59.75 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 108.218 -1.031 . . . . 74.14 108.218 172.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -58.98 -47.55 84.75 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.231 1.012 . . . . 72.22 111.189 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -30.14 66.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 118.012 -0.994 . . . . 72.43 111.712 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.3 -38.35 65.82 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-N 119.728 1.149 . . . . 65.5 111.204 170.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -64.01 -26.42 68.56 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.777 0.717 . . . . 74.54 111.525 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -74.88 -18.04 60.49 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.685 -0.634 . . . . 74.43 112.051 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -88.52 140.5 29.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.203 1.001 . . . . 74.55 109.521 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -69.23 176.22 3.42 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.27 -1.332 . . . . 72.34 109.367 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -54.76 -59.28 4.93 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.22 -1.354 . . . . 74.25 111.673 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.56 -27.89 45.91 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 119.64 -0.219 . . . . 72.33 110.972 -170.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.17 -48.96 79.29 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.424 -1.47 . . . . 74.11 109.424 171.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.84 -43.99 94.33 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.807 0.803 . . . . 72.13 110.576 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.91 -36.29 83.47 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.5 -0.75 . . . . 63.15 112.012 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -43.85 82.56 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.029 0.831 . . . . 72.1 110.517 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 65.5 t -55.07 -42.09 62.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 123.255 0.622 . . . . 64.51 109.729 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.42 -38.06 56.14 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 121.77 -0.581 . . . . 71.11 111.653 -175.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.45 -28.85 68.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.727 -0.654 . . . . 62.43 110.617 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -75.42 -36.28 60.82 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.925 0.784 . . . . 73.43 110.48 171.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -56.48 -57.74 11.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.976 0.91 . . . . 74.2 111.63 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.458 ' HE2' HD13 ' A' ' 29' ' ' LEU . 34.0 ttmt -63.54 -30.15 71.31 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.548 0.613 . . . . 73.41 111.46 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -73.83 10.23 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.323 1.449 . . . . 74.03 113.117 -172.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.2 m -112.57 165.98 11.75 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.486 1.514 . . . . 61.32 111.666 -173.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -95.99 105.54 17.59 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 107.713 -1.218 . . . . 71.33 107.713 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.471 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 91.8 mt -92.22 -7.28 48.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.698 -0.683 . . . . 72.14 112.823 -171.451 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 m -60.29 -27.01 66.95 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.433 1.642 . . . . 74.21 115.433 -169.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -131.72 16.11 4.82 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.344 1.057 . . . . 72.21 111.439 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -64.04 154.28 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.573 1.149 . . . . 73.54 109.966 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -63.64 1.24 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.374 -0.376 . . . . 74.4 110.355 -178.291 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -127.1 134.76 50.18 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 106.638 -1.616 . . . . 71.24 106.638 166.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HE3' ' HB3' ' A' ' 63' ' ' LEU . 29.8 mmtm -59.57 -27.4 66.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.084 0.865 . . . . 70.51 111.051 172.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.7 p -72.66 -53.08 12.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.473 0.709 . . . . 70.44 110.398 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.96 -38.91 65.47 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.8 0.44 . . . . 71.53 111.425 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -60.05 -51.78 68.17 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.732 0.777 . . . . 65.41 109.531 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.9 tp -62.17 -52.07 65.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.705 -0.85 . . . . 73.32 108.705 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 11.9 t -57.65 -28.22 63.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.03 0.932 . . . . 62.24 111.448 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.43 -49.6 50.21 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 111.16 -0.776 . . . . 61.51 111.16 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.94 -37.85 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 117.826 0.813 . . . . 74.13 111.254 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.2 mtt -55.21 -44.83 75.76 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.0 -1.063 . . . . 73.13 111.09 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -58.5 -50.68 72.86 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.01 0.924 . . . . 73.41 110.723 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 t -68.63 -36.35 78.51 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.605 -1.188 . . . . 74.34 111.112 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -65.23 -31.11 72.1 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 122.245 2.293 . . . . 65.31 112.798 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 mmm-85 -69.52 -28.19 65.82 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 121.173 -0.954 . . . . 73.5 111.279 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -141.39 81.86 1.8 Allowed 'General case' 0 C--O 1.241 0.65 0 C-N-CA 125.857 1.663 . . . . 64.14 110.471 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -132.5 82.11 1.99 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 105.318 -2.105 . . . . 65.04 105.318 169.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -132.38 172.48 12.41 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.898 1.679 . . . . 73.31 109.561 175.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.406 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 7.6 mmpt? . . . . . 0 C--O 1.249 1.041 0 C-N-CA 128.97 2.908 . . . . 73.31 110.114 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.552 0 N-CA-C 110.564 -1.014 . . . . 75.35 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.55 -179.97 7.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.675 1.226 . . . . 75.22 110.476 174.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -28.97 67.13 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 114.733 -1.121 . . . . 74.42 112.219 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -52.71 -31.35 37.22 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.865 1.266 . . . . 73.13 112.86 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.4 -42.82 74.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.264 0.626 . . . . 74.25 110.948 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -64.27 -46.44 83.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.279 1.031 . . . . 73.34 111.999 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -70.24 -30.36 67.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.022 0.828 . . . . 70.25 110.365 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.58 -47.87 79.73 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 120.86 -1.15 . . . . 74.41 109.505 172.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 29.0 mt -65.25 -15.04 62.06 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.928 0.891 . . . . 73.32 113.175 178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.479 ' C ' ' H ' ' A' ' 12' ' ' GLY . 9.3 t0 -87.88 -42.14 12.72 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.501 1.92 . . . . 64.44 110.431 174.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.16 15.81 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.684 2.794 . . . . 74.21 112.902 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.479 ' H ' ' C ' ' A' ' 10' ' ' ASP . . . 77.35 12.33 84.66 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 127.174 2.321 . . . . 54.21 112.641 175.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.8 mt -85.71 145.98 42.84 Favored Pre-proline 0 C--O 1.237 0.417 0 CA-C-N 118.424 1.112 . . . . 74.23 108.908 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -71.02 167.75 25.18 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.578 2.186 . . . . 53.45 112.478 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 46.6 tt0 -70.84 -48.07 55.93 Favored 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 124.974 1.309 . . . . 70.33 110.053 -174.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -62.45 -40.15 95.67 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 119.457 -0.897 . . . . 72.51 111.107 -172.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 76.6 t -60.53 -57.07 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.178 -1.045 . . . . 72.15 108.178 172.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.72 -42.1 62.02 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.411 1.085 . . . . 74.45 113.55 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.12 -52.34 64.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.96 0.904 . . . . 73.51 110.566 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -28.58 62.34 Favored 'General case' 0 N--CA 1.461 0.085 0 O-C-N 121.694 -0.629 . . . . 74.24 110.144 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -68.23 -35.24 77.65 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.731 0.696 . . . . 74.23 111.28 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -53.03 -43.43 66.57 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.731 1.213 . . . . 73.31 111.57 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -64.57 -15.34 60.89 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 125.633 1.573 . . . . 72.55 113.883 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -76.5 -42.52 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.921 -1.14 . . . . 75.42 107.921 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -84.39 -10.47 57.53 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 113.586 0.958 . . . . 75.45 113.586 -172.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.4 t -86.59 -19.92 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 119.081 0.855 . . . . 72.34 110.576 170.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.64 7.26 30.71 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.272 -0.893 . . . . 72.25 113.371 -165.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.19 5.55 48.95 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.31 -0.869 . . . . 71.04 113.848 -175.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -77.1 -61.08 2.1 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.805 1.302 . . . . 75.33 109.15 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.14 -174.25 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 123.664 0.785 . . . . 74.42 110.634 176.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -124.65 154.96 39.96 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.499 2.32 . . . . 73.41 107.585 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -57.91 -19.47 30.04 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.699 1.0 . . . . 72.35 113.699 -174.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -104.41 15.35 28.38 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.832 -1.167 . . . . 64.43 111.871 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -67.41 -18.48 65.13 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.92 -1.737 . . . . 74.25 114.228 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 85.2 mt -90.58 167.81 12.27 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.703 0.801 . . . . 75.32 111.59 -171.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.97 156.84 17.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.629 -1.619 . . . . 60.35 106.629 171.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -64.35 -30.02 71.08 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.564 -0.71 . . . . 72.25 110.27 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -55.12 -22.48 16.83 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.446 1.098 . . . . 71.21 113.611 170.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -92.94 -44.52 8.4 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.004 1.322 . . . . 73.35 110.925 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.25 -42.53 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 119.146 0.885 . . . . 75.44 109.36 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -51.09 -49.3 60.96 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.498 1.119 . . . . 74.22 111.135 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.8 92.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.903 0.481 . . . . 74.24 110.092 -172.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 mt -58.44 -34.19 70.55 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.598 0.592 . . . . 73.12 112.598 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -60.54 -26.99 67.3 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 119.126 -0.464 . . . . 73.02 111.54 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -80.13 -18.19 50.5 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.81 1.041 . . . . 72.21 113.81 -168.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -87.12 155.41 20.13 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.008 1.323 . . . . 73.43 110.006 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -79.56 -177.66 5.93 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.273 1.429 . . . . 74.11 110.397 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -52.14 -70.86 0.08 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.109 1.764 . . . . 73.54 110.492 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -60.92 -45.59 94.05 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 124.886 1.275 . . . . 75.45 109.994 -174.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -55.78 -54.7 33.22 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 110.207 -1.157 . . . . 52.01 110.207 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.57 76.32 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.882 0.841 . . . . 65.45 110.672 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.61 -41.54 66.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.207 1.003 . . . . 75.41 110.815 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.98 79.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.882 0.31 . . . . 74.13 110.505 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 11.0 t -58.97 -34.99 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 124.474 1.109 . . . . 75.22 110.471 -179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.9 -43.24 83.91 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.498 0.719 . . . . 75.21 109.985 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -43.97 92.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.122 -1.436 . . . . 72.23 107.122 -177.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -76.3 -33.71 59.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.488 -0.56 . . . . 74.12 109.488 -168.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -60.15 -62.7 1.68 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.471 1.108 . . . . 75.15 110.785 171.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -44.54 62.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.967 1.707 . . . . 74.43 111.701 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.22 15.05 0.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.852 1.261 . . . . 74.21 113.47 -173.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.7 m -112.53 173.68 6.26 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.478 1.511 . . . . 62.32 111.383 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -103.41 123.94 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.498 -1.667 . . . . 71.23 106.498 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.8 mt -105.68 -9.55 17.26 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 125.256 1.423 . . . . 75.53 112.242 -171.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.5 m -56.68 -26.81 57.43 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.717 2.007 . . . . 75.32 114.637 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -122.91 11.57 9.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.573 1.149 . . . . 75.53 110.924 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.7 t -71.38 127.83 33.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 O-C-N 120.891 -1.13 . . . . 75.55 108.205 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -64.29 -56.73 12.51 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.136 1.775 . . . . 73.13 110.379 -175.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -128.77 126.01 39.05 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 105.291 -2.114 . . . . 75.33 105.291 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -60.96 -27.78 68.5 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.558 0.536 . . . . 73.43 111.629 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 12.4 p -73.77 -54.05 8.92 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.127 2.171 . . . . 73.43 110.81 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.01 64.69 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 118.356 0.525 . . . . 71.32 111.984 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -67.21 -46.5 73.68 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 120.603 0.24 . . . . 74.55 110.535 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -62.54 -42.88 99.81 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.811 0.444 . . . . 73.35 110.171 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.64 -28.4 63.67 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.14 -0.933 . . . . 75.34 112.557 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.6 -55.98 6.33 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.356 0.979 . . . . 40.03 111.907 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 22.4 t -62.05 -39.97 85.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 118.023 0.911 . . . . 71.53 109.863 -173.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 28.7 mtm -57.21 -42.1 80.7 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.483 -1.385 . . . . 62.33 111.491 172.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -61.76 -38.86 89.58 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 121.79 -0.569 . . . . 74.12 110.654 -177.106 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -50.89 61.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.371 -0.823 . . . . 72.24 110.515 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -54.22 -32.68 56.46 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.557 0.947 . . . . 73.55 113.557 177.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -13.53 61.24 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 114.227 1.195 . . . . 74.15 114.227 175.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.18 73.9 1.57 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 125.053 1.341 . . . . 73.11 108.497 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.9 mtp85 -140.29 24.69 2.29 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.819 2.448 . . . . 75.55 110.002 175.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.18 94.35 1.54 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.992 0.917 . . . . 52.14 108.818 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.968 0 C-N-CA 127.537 2.335 . . . . 72.23 104.918 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.698 0 N-CA-C 110.287 -1.125 . . . . 61.02 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -119.43 178.9 4.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.555 0.742 . . . . 61.31 110.845 177.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -31.98 46.18 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.726 1.211 . . . . 75.42 113.769 -176.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -57.85 -33.9 69.15 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.358 1.063 . . . . 63.34 111.739 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -52.84 -56.72 13.74 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.298 1.039 . . . . 75.41 111.657 -172.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -57.93 -32.33 67.68 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.636 0.775 . . . . 75.1 111.536 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.0 m -67.18 -33.64 75.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 117.917 -1.039 . . . . 73.21 110.907 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.48 -39.81 94.64 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.698 2.044 . . . . 73.24 110.189 175.671 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -66.51 -16.56 64.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.502 0.721 . . . . 74.24 112.076 178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -93.51 -39.4 10.89 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.498 1.919 . . . . 73.22 109.728 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.413 ' O ' ' HE2' ' A' ' 44' ' ' LYS . . . -70.35 8.0 0.9 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 129.805 3.242 . . . . 72.13 112.913 -174.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 109.47 -0.37 30.9 Favored Glycine 0 N--CA 1.439 -1.158 0 C-N-CA 124.979 1.276 . . . . 73.13 113.577 172.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -105.3 154.76 38.71 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 119.275 1.537 . . . . 75.33 112.329 -162.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -78.63 172.76 14.65 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.066 2.51 . . . . 73.11 111.789 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.24 -42.46 59.67 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 118.219 -0.896 . . . . 74.01 110.712 -174.09 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -64.72 -41.62 95.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 118.732 -1.187 . . . . 64.44 110.565 -167.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.9 t -58.07 -56.46 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 125.59 1.556 . . . . 75.12 108.739 168.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -37.16 67.85 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.037 0.754 . . . . 63.04 113.037 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.421 ' C ' ' HE3' ' A' ' 20' ' ' LYS . 3.8 mt-10 -63.33 -20.66 65.7 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.264 1.026 . . . . 74.34 112.744 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.421 ' HE3' ' C ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -98.25 -32.48 11.54 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.23 0.923 . . . . 74.24 110.46 170.127 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.17 -31.67 71.38 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 125.116 1.366 . . . . 74.02 111.129 -175.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -54.52 -51.17 65.98 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 126.193 1.797 . . . . 72.04 112.033 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.91 -34.52 28.76 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.672 2.389 . . . . 73.15 112.503 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.9 mt -63.42 -28.17 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 108.447 -0.946 . . . . 75.32 108.447 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -104.42 13.11 32.52 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.804 1.642 . . . . 75.45 112.805 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -111.06 -36.18 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.306 1.042 . . . . 73.21 109.912 173.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.93 9.62 3.45 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.009 -1.057 . . . . 74.15 112.981 -174.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.03 11.46 66.89 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 118.999 -0.889 . . . . 72.12 113.147 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.408 HD12 ' HE2' ' A' ' 59' ' ' LYS . 88.6 mt -66.12 -65.85 0.62 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.522 1.161 . . . . 70.03 108.121 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 27.3 m -135.45 164.02 34.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 O-C-N 123.238 0.336 . . . . 75.44 111.213 -173.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -90.15 155.2 19.2 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.208 1.003 . . . . 75.41 110.269 175.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -63.01 -23.81 67.63 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.259 -0.901 . . . . 63.34 112.209 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -100.5 12.88 36.32 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.76 1.022 . . . . 73.32 113.76 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.22 -26.35 62.0 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.601 -1.312 . . . . 75.44 112.579 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.9 mt -76.51 156.57 32.84 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.381 0.672 . . . . 74.21 110.835 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -110.25 173.59 6.26 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.834 1.653 . . . . 73.03 108.996 171.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -35.76 75.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 75.31 111.322 -164.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -66.02 -20.43 66.18 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 118.504 -0.76 . . . . 75.31 111.975 -176.407 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.64 18.52 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.309 0.959 . . . . 72.44 110.797 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.3 mm -67.09 -38.94 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 108.344 -0.984 . . . . 72.04 108.344 174.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -61.59 -45.56 93.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.481 -0.762 . . . . 74.43 110.473 172.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.13 -42.85 95.68 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.273 -0.394 . . . . 75.24 111.48 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.82 -49.08 74.23 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.978 0.911 . . . . 74.41 111.447 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -53.23 -19.53 3.21 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.818 1.647 . . . . 73.14 113.931 178.921 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.57 -20.36 26.55 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 120.168 1.349 . . . . 75.31 114.224 -170.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -90.0 152.38 21.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.141 0.976 . . . . 74.03 111.127 -165.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -74.03 -175.51 2.22 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.486 -1.234 . . . . 74.01 110.337 164.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -53.37 -68.0 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 124.71 1.204 . . . . 75.03 112.089 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -72.04 -35.3 69.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.086 -0.709 . . . . 73.41 109.086 -173.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.99 -46.12 70.02 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 110.93 -0.868 . . . . 75.12 110.93 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.17 -51.53 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 118.365 -0.826 . . . . 75.33 109.686 177.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.07 -43.45 70.29 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.01 0.924 . . . . 74.41 111.478 -178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.406 1.082 . . . . 70.01 111.027 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 89.6 t -57.69 -44.31 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 109.434 -0.58 . . . . 74.33 109.434 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -69.14 -49.12 59.84 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 123.487 0.715 . . . . 72.32 109.285 -173.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -51.35 -60.41 3.15 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 127.154 2.181 . . . . 70.25 108.298 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -63.86 -35.48 80.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.188 0.518 . . . . 74.01 110.649 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -66.53 -55.78 13.92 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.856 0.862 . . . . 71.34 110.891 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.408 ' HE2' HD12 ' A' ' 29' ' ' LEU . 2.0 ttmm -64.29 -29.71 70.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.777 0.831 . . . . 71.25 111.997 177.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -76.55 33.81 0.14 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.694 1.997 . . . . 65.53 111.299 172.304 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -140.93 171.57 13.89 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.645 2.378 . . . . 64.34 109.768 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -119.83 121.12 38.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.743 2.017 . . . . 73.33 106.696 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 22.1 mt -112.72 7.77 18.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.816 1.647 . . . . 75.12 112.213 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.4 t -58.67 -30.93 67.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.674 1.59 . . . . 71.01 111.724 -173.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -120.39 41.92 3.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 124.296 1.038 . . . . 75.42 109.424 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.6 t -129.74 111.05 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 124.37 1.068 . . . . 74.01 108.477 171.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -57.34 -64.28 0.94 Allowed 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.52 0.728 . . . . 75.44 109.571 171.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -81.25 89.36 6.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.831 0.824 . . . . 74.24 109.988 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -61.74 -37.01 82.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.615 -0.72 . . . . 75.13 111.112 178.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 p -61.94 -56.28 20.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 124.656 1.182 . . . . 73.44 108.715 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.473 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . . . -63.01 -20.7 65.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.023 1.12 . . . . 61.32 114.023 -174.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -73.98 -56.37 5.03 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.641 -0.874 . . . . 71.12 108.641 174.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.68 -48.51 81.48 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 125.077 1.351 . . . . 72.05 109.36 -172.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 71' ' ' ALA . 1.7 p -59.16 -30.58 68.27 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.198 -1.365 . . . . 72.24 109.443 -175.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.2 -45.36 71.34 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 125.039 1.304 . . . . 61.12 111.818 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.3 t -57.5 -40.79 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 118.964 1.382 . . . . 71.41 109.544 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.4 mtt -62.72 -36.18 82.16 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.828 -1.17 . . . . 74.22 110.931 175.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.0 tttp -62.69 -56.89 13.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.033 -0.729 . . . . 63.23 109.033 -176.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.94 -51.48 61.26 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.244 -0.884 . . . . 71.21 108.98 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.47 -33.84 73.17 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 115.355 1.613 . . . . 75.13 115.355 -173.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.12 -10.22 59.75 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.539 0.609 . . . . 75.05 111.22 177.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -138.12 68.85 1.39 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.947 2.099 . . . . 63.44 109.333 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -119.99 64.33 0.82 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.892 1.677 . . . . 74.04 107.446 174.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.17 -164.38 0.94 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 125.428 1.491 . . . . 71.03 108.812 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.07 0 C-N-CA 125.035 1.334 . . . . 74.04 108.468 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.665 0 N-CA-C 111.439 -0.664 . . . . 75.5 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.35 179.38 7.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 122.562 1.172 . . . . 72.12 109.891 168.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -52.35 -31.8 35.29 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.612 2.365 . . . . 75.1 113.776 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -66.11 -34.73 78.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.12 0.568 . . . . 64.31 109.87 -172.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -45.12 -54.12 7.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.879 1.671 . . . . 73.15 111.998 -176.629 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -70.27 -39.69 74.79 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 112.199 0.444 . . . . 73.23 112.199 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.8 m -66.43 -34.42 77.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.115 0.566 . . . . 75.42 110.389 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.03 -48.22 77.16 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.293 -0.879 . . . . 75.54 110.308 171.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 21.8 mt -60.32 -21.38 61.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.928 0.891 . . . . 75.34 112.0 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -81.85 -28.38 33.06 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.286 0.634 . . . . 75.25 110.917 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.28 11.27 1.99 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.208 1.403 . . . . 72.33 112.11 -167.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.06 5.36 53.29 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 124.465 1.031 . . . . 73.22 112.48 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.8 mt -97.51 145.44 29.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 118.267 1.034 . . . . 62.44 111.022 -165.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.87 179.58 3.13 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 125.187 3.925 . . . . 72.23 112.72 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -54.91 8.83 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 120.567 -1.333 . . . . 75.43 109.026 172.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -65.39 -31.97 73.35 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 113.369 0.877 . . . . 74.21 113.369 -160.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.4 t -74.68 -54.09 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.738 -1.208 . . . . 75.31 107.738 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.17 -35.88 38.34 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.929 1.292 . . . . 51.32 112.033 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -36.14 68.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.098 0.959 . . . . 73.12 112.585 177.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.46 -34.96 16.25 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.082 -1.011 . . . . 74.23 110.16 172.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.19 -25.05 60.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.629 1.171 . . . . 75.54 112.715 -168.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -56.68 -47.6 79.49 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.071 0.948 . . . . 75.51 110.761 175.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.94 -30.45 64.03 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.939 1.695 . . . . 64.44 112.144 -174.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.3 mt -64.58 -31.62 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.834 0.853 . . . . 75.44 109.328 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -85.94 -21.73 27.77 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.506 0.558 . . . . 72.22 112.506 177.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 64.1 t -65.91 -50.94 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 118.694 0.679 . . . . 70.22 110.472 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.63 -7.25 53.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.628 0.771 . . . . 73.44 112.995 -161.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 80.93 29.66 41.33 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.637 -0.664 . . . . 62.4 112.398 -170.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.482 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.3 mt -76.34 -44.85 34.81 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-N 117.848 0.824 . . . . 73.12 109.411 173.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.3 m -144.96 149.38 16.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 118.256 0.48 . . . . 74.31 110.953 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.39 147.18 38.21 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.674 -0.861 . . . . 74.14 108.674 160.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -62.66 -43.62 98.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.944 -0.472 . . . . 74.43 110.161 171.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.6 m -79.89 19.56 0.68 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.085 0.772 . . . . 75.33 113.085 172.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.93 -42.47 48.72 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 120.319 1.418 . . . . 75.22 108.758 157.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -62.45 131.56 49.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.733 0.813 . . . . 71.34 110.054 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.86 170.1 10.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.719 1.207 . . . . 74.4 109.712 169.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.07 -30.56 62.16 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.046 1.338 . . . . 75.31 112.307 -173.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.48 -37.36 78.03 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.369 0.668 . . . . 75.41 110.928 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.82 34.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.632 0.773 . . . . 42.41 111.125 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.8 mm -58.71 -49.06 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.683 0.793 . . . . 74.41 109.183 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -55.63 -56.7 17.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.154 1.382 . . . . 75.13 109.76 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.56 75.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.724 0.809 . . . . 63.51 111.774 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mt -57.86 -38.01 74.92 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 113.007 0.743 . . . . 74.44 113.007 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.94 -32.89 74.82 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.566 0.621 . . . . 74.53 111.506 174.31 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -73.73 -15.6 61.21 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.006 0.743 . . . . 63.45 113.006 -171.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -89.18 132.85 34.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 119.076 0.853 . . . . 75.32 110.502 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -65.03 175.33 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.263 -1.335 . . . . 75.15 111.749 166.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -48.32 -64.07 0.9 Allowed 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.935 2.094 . . . . 74.52 111.788 -176.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.71 -36.69 57.03 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 122.831 0.452 . . . . 72.42 110.887 -175.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.61 -36.33 93.21 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 111.182 -0.767 . . . . 74.02 111.182 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.78 61.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.168 0.987 . . . . 75.42 109.911 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.09 -39.02 77.53 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.204 0.456 . . . . 75.25 110.286 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.42 91.89 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.292 0.637 . . . . 73.03 111.762 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -54.31 -44.35 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 109.42 -0.585 . . . . 75.12 109.42 173.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.9 mt -70.28 -47.05 62.94 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.339 -0.986 . . . . 72.41 108.339 -169.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -56.58 -56.17 24.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.46 1.504 . . . . 73.23 110.242 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -62.58 -41.0 98.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.408 1.099 . . . . 73.1 109.66 -174.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.66 -49.68 75.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 125.184 1.394 . . . . 75.42 110.797 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.482 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -71.39 -28.89 64.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.965 -1.084 . . . . 75.1 113.415 -179.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -75.73 -1.09 23.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.253 0.621 . . . . 72.22 111.463 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 m -83.77 172.05 12.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.585 1.539 . . . . 74.21 109.63 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -117.48 91.37 3.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.21 1.004 . . . . 73.34 110.301 -171.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.9 mt -79.99 -2.81 45.69 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.081 0.952 . . . . 74.52 113.417 -166.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.7 t -47.96 -60.92 2.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.174 1.79 . . . . 61.43 110.56 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -88.05 31.15 0.8 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.294 1.038 . . . . 73.32 111.899 -172.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -123.03 120.75 61.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 106.77 -1.567 . . . . 74.34 106.77 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -73.05 -51.01 19.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.874 0.87 . . . . 73.12 109.23 175.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -106.71 80.97 1.51 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 127.192 2.197 . . . . 72.53 108.195 -160.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -51.76 -37.4 51.15 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.262 -1.336 . . . . 74.24 111.251 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.9 p -64.08 -56.4 15.22 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 124.203 1.001 . . . . 73.24 109.824 -173.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.77 -36.34 72.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.33 0.652 . . . . 63.41 111.053 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.26 -53.82 46.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.69 -0.804 . . . . 75.33 109.499 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.47 -53.84 52.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.338 1.455 . . . . 71.33 109.598 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.1 t -62.0 -31.64 72.03 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.009 -0.996 . . . . 60.42 110.105 -175.07 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.0 -49.22 68.31 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 118.932 -0.926 . . . . 62.34 111.411 169.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -59.18 -47.08 91.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 118.517 1.159 . . . . 75.14 109.527 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 35.3 mtt -53.41 -47.5 69.53 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.69 -0.631 . . . . 74.32 110.53 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -58.8 -45.48 89.8 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.838 -0.601 . . . . 75.53 110.049 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -47.05 86.79 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.852 0.751 . . . . 72.41 110.556 174.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -60.3 -42.94 96.58 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 113.056 0.762 . . . . 75.42 113.056 -177.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -69.02 -11.01 60.4 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.815 0.734 . . . . 72.52 111.339 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -134.69 74.33 1.52 Allowed 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 125.427 1.491 . . . . 73.51 110.107 -175.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -117.37 90.7 3.39 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.265 -1.013 . . . . 74.44 108.265 165.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -123.77 156.0 36.87 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.306 1.042 . . . . 74.21 108.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? . . . . . 0 C--O 1.25 1.101 0 C-N-CA 125.515 1.526 . . . . 73.34 109.31 -179.484 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.563 0 CA-C-O 121.253 0.363 . . . . 54.31 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.86 -173.95 4.87 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.575 1.95 . . . . 64.33 109.276 163.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.1 pm0 -77.33 -26.32 51.98 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 120.733 -1.229 . . . . 75.35 112.918 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -58.47 -20.49 45.78 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.281 0.946 . . . . 63.12 113.16 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -48.61 -46.89 40.18 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.526 1.131 . . . . 75.24 112.266 -176.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -65.99 -40.06 90.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.876 0.47 . . . . 75.42 111.5 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.2 m -59.9 -37.93 80.82 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.986 0.914 . . . . 75.44 110.31 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -72.27 -44.16 63.21 Favored 'General case' 0 CA--C 1.52 -0.194 0 C-N-CA 123.947 0.899 . . . . 74.24 111.253 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.67 -26.35 44.22 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.787 0.835 . . . . 74.22 111.351 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.96 -17.79 39.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.783 0.833 . . . . 74.43 112.632 -178.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.04 19.78 5.44 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.255 1.422 . . . . 73.22 113.72 -161.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.95 23.8 75.48 Favored Glycine 0 CA--C 1.525 0.667 0 O-C-N 121.577 -0.702 . . . . 54.43 112.512 -173.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.1 mt -112.06 146.17 34.28 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 124.959 1.304 . . . . 74.54 109.173 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.05 165.84 31.06 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.508 2.139 . . . . 72.11 111.09 177.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -60.17 -41.31 92.6 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.683 0.793 . . . . 74.22 108.891 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -58.02 -44.69 87.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.446 -0.797 . . . . 74.44 111.718 -171.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.4 t -70.94 -48.97 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.557 -1.275 . . . . 74.25 107.557 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.54 67.85 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.106 0.78 . . . . 72.25 113.106 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -50.35 -41.04 50.88 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.333 1.453 . . . . 75.14 113.893 172.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.52 -24.28 19.69 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 118.507 -0.759 . . . . 74.21 112.165 177.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.01 -34.52 43.93 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 118.962 0.801 . . . . 74.22 111.088 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -57.09 -41.35 78.71 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.872 0.844 . . . . 73.05 111.164 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -27.71 52.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 127.886 2.474 . . . . 74.22 112.446 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 23.3 mm -71.51 -37.3 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 N-CA-C 107.726 -1.213 . . . . 71.42 107.726 -177.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -83.03 -10.52 58.7 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.454 1.102 . . . . 75.02 112.471 -176.125 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.3 t -73.77 -42.73 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 O-C-N 121.213 -0.929 . . . . 63.24 109.803 171.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.88 37.1 2.64 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.726 0.81 . . . . 53.54 112.152 -144.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.01 18.63 57.74 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 124.954 1.264 . . . . 74.34 115.085 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.2 mt -85.12 -65.78 0.97 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.348 1.074 . . . . 72.02 109.165 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.3 m -139.39 166.54 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.823 1.249 . . . . 74.23 110.369 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.49 162.93 12.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.234 1.413 . . . . 51.41 108.558 156.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -58.32 -35.36 71.76 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.847 0.748 . . . . 72.53 110.604 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.1 p -81.69 -5.31 57.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.537 1.135 . . . . 75.11 112.303 -174.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.61 -16.93 46.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.866 0.757 . . . . 63.41 112.471 -169.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -90.61 -175.24 4.36 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.133 1.773 . . . . 71.55 110.55 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -114.02 170.77 8.03 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.213 1.405 . . . . 72.52 109.828 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -46.57 -44.74 18.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.959 1.304 . . . . 72.41 110.608 164.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -64.49 -22.79 67.07 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.774 0.657 . . . . 72.43 112.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.28 -52.49 18.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.138 0.881 . . . . 71.13 109.902 171.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.02 -53.81 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 C-N-CA 125.144 1.377 . . . . 64.41 109.35 -175.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -64.02 -44.64 91.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.613 -0.232 . . . . 74.14 111.372 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.58 -38.52 87.83 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.178 -0.304 . . . . 75.34 110.178 -176.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 mt -52.59 -41.63 63.8 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.604 0.762 . . . . 75.12 111.952 173.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -59.22 -55.13 38.84 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.453 0.57 . . . . 75.51 110.081 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -74.18 -1.19 19.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 116.281 1.956 . . . . 73.31 116.281 -162.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.7 159.27 25.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.127 0.971 . . . . 74.33 110.309 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.7 p-10 -75.77 -179.65 4.9 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.185 0.994 . . . . 72.43 109.426 159.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -44.77 -70.87 0.09 Allowed 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 126.978 2.111 . . . . 75.24 110.722 171.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.26 -28.97 60.03 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 112.072 0.397 . . . . 75.05 112.072 -166.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.64 -40.44 94.04 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 110.416 -1.074 . . . . 62.45 110.416 174.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.75 -49.29 76.99 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.48 -0.771 . . . . 75.13 110.374 171.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.46 -38.85 72.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.589 1.086 . . . . 75.43 111.309 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -50.45 73.95 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.783 1.233 . . . . 71.35 111.069 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 63.2 t -52.28 -42.19 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.316 0.647 . . . . 75.22 110.141 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -71.49 -45.64 61.95 Favored 'General case' 0 CA--C 1.516 -0.345 0 O-C-N 122.345 -0.222 . . . . 75.34 110.414 -169.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -54.05 -56.86 14.01 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.88 1.272 . . . . 64.01 108.935 173.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -70.56 -6.68 38.26 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.099 0.777 . . . . 74.24 113.099 -168.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -93.87 -38.91 10.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.027 1.731 . . . . 74.22 111.701 174.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 4.9 mmtt -60.49 -35.27 75.53 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.64 1.109 . . . . 75.25 109.579 165.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -79.46 46.51 0.75 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.904 1.682 . . . . 64.02 109.077 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.2 m -153.76 167.07 30.84 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.304 -1.498 . . . . 74.42 111.705 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -99.78 116.33 31.62 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 126.529 1.932 . . . . 72.41 106.416 175.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.8 mt -114.03 8.7 17.16 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 126.589 1.956 . . . . 74.12 109.92 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 m -75.27 -58.82 3.05 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 126.978 2.111 . . . . 75.24 108.775 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -78.03 0.67 23.64 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 113.34 0.867 . . . . 75.35 113.34 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 48.9 t -82.7 141.25 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 120.937 -1.102 . . . . 62.52 109.819 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -69.13 0.54 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.428 1.491 . . . . 75.21 110.282 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -111.42 100.93 9.43 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 127.34 2.256 . . . . 73.45 107.912 -163.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -60.64 -31.98 71.17 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.495 1.118 . . . . 74.45 112.83 -165.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -57.0 -49.17 76.6 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.848 1.659 . . . . 74.15 108.757 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.12 -5.63 36.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 113.458 0.91 . . . . 51.23 113.458 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -91.0 -56.33 3.21 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 119.872 -0.731 . . . . 73.11 109.38 163.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.26 -50.8 70.27 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 126.117 1.767 . . . . 75.32 109.674 -165.555 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.7 t -55.09 -36.16 65.36 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.239 -1.346 . . . . 71.23 109.473 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.95 -42.04 97.06 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.002 -0.888 . . . . 75.35 112.7 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.7 t -60.53 -46.35 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 119.097 1.449 . . . . 60.54 108.653 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.4 mtt -58.54 -40.44 83.02 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.604 -0.685 . . . . 74.15 109.995 176.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -53.75 54.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.485 -0.769 . . . . 62.35 110.963 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -63.05 -42.94 99.84 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.7 -0.667 . . . . 63.44 109.788 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -60.09 -38.04 81.76 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.742 1.61 . . . . 75.04 112.523 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -21.33 59.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.592 0.757 . . . . 75.23 110.242 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -134.44 60.2 1.71 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.263 1.825 . . . . 75.33 111.423 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.48 -0.79 27.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.797 1.239 . . . . 73.14 112.249 177.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -62.93 108.27 1.17 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 107.465 -1.309 . . . . 74.54 107.465 164.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.885 0 C-N-CA 126.671 1.988 . . . . 73.51 105.705 165.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.794 0 N-CA-C 111.384 -0.686 . . . . 72.0 111.384 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -96.36 -167.77 1.63 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.552 1.141 . . . . 75.42 110.28 166.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.07 -33.22 51.07 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 125.773 1.629 . . . . 71.11 113.264 -175.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.95 -41.93 97.24 Favored 'General case' 0 C--O 1.227 -0.114 0 C-N-CA 124.797 1.239 . . . . 64.44 110.168 -179.168 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -45.94 -60.93 1.97 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.945 1.698 . . . . 75.14 112.754 -170.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -63.38 -33.41 75.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.223 -0.417 . . . . 74.34 111.494 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.15 -39.61 86.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.462 -0.78 . . . . 73.23 109.364 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.12 96.07 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 120.011 1.278 . . . . 72.4 109.71 174.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.26 -16.81 61.44 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.996 0.918 . . . . 71.24 112.879 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -105.71 -17.79 14.28 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.26 1.824 . . . . 64.0 110.767 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.32 30.29 0.71 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 127.507 2.323 . . . . 74.4 110.813 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.439 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 82.38 3.2 90.63 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-O 117.784 -1.564 . . . . 71.1 114.277 173.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.2 mt -104.29 157.24 34.48 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.939 1.87 . . . . 73.13 112.92 -172.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.67 170.58 19.9 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 124.346 3.364 . . . . 63.3 113.739 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -66.4 -47.63 72.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 124.985 1.314 . . . . 74.43 109.728 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -42.52 86.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.16 0.43 . . . . 72.23 112.16 -166.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.93 -57.12 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 126.791 2.036 . . . . 75.3 107.285 173.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.14 -42.69 63.56 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 124.659 1.184 . . . . 73.14 112.491 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.11 -45.55 71.9 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.04 0.936 . . . . 74.33 110.217 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -38.54 28.07 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 119.289 -0.386 . . . . 75.44 110.6 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.33 -41.38 94.0 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.736 1.215 . . . . 75.02 110.88 -174.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.23 -44.31 75.34 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.885 1.274 . . . . 75.31 110.547 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -33.36 67.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.453 1.101 . . . . 73.44 112.858 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -66.93 -25.25 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.78 0.832 . . . . 74.03 109.483 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.68 -31.84 14.29 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.08 0.952 . . . . 74.31 111.855 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -53.19 -53.47 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.475 0.71 . . . . 75.31 110.883 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 1.75 17.13 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.755 0.65 . . . . 72.03 112.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.08 25.88 72.27 Favored Glycine 0 CA--C 1.528 0.885 0 O-C-N 120.782 -1.199 . . . . 54.54 112.88 174.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.437 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 1.8 mp -59.88 -43.88 94.5 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.203 1.501 . . . . 75.14 108.067 168.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -132.01 168.63 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 126.278 1.831 . . . . 75.24 108.224 167.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.97 161.29 13.81 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 107.862 -1.162 . . . . 73.2 107.862 165.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -59.28 -10.22 2.84 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.095 1.517 . . . . 75.23 115.095 -172.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.69 42.86 3.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.101 1.76 . . . . 73.4 109.73 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -74.47 -10.15 59.28 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 127.793 2.437 . . . . 72.0 113.647 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 mt -101.24 158.56 15.95 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 122.958 0.503 . . . . 71.34 112.142 -167.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -91.2 163.2 14.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.999 1.32 . . . . 74.03 109.351 167.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -46.99 -51.94 15.93 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.188 2.195 . . . . 72.42 111.784 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -76.79 -9.27 58.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.362 -0.828 . . . . 75.34 111.353 -172.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.26 -47.59 41.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.197 -1.382 . . . . 75.22 109.387 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.72 -52.09 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 120.597 1.544 . . . . 72.11 109.901 174.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.91 -40.44 88.82 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.969 0.729 . . . . 64.0 112.969 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.2 -23.24 54.65 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.502 1.046 . . . . 72.23 112.67 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.88 -32.03 73.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.16 0.984 . . . . 74.0 110.415 171.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.439 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 1.0 OUTLIER -62.13 -13.18 24.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.819 1.247 . . . . 72.43 112.89 174.13 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -104.85 2.99 30.54 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.047 0.939 . . . . 65.33 112.852 -171.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -97.47 160.25 14.44 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 120.626 -1.297 . . . . 74.0 109.98 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -86.73 178.4 7.03 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.349 1.46 . . . . 73.14 110.107 164.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -52.35 -68.04 0.2 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 127.275 2.23 . . . . 72.31 110.153 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.02 -34.0 77.08 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.92 -0.488 . . . . 75.12 111.781 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -61.39 -59.5 9.81 Favored Glycine 0 C--N 1.34 0.763 0 N-CA-C 109.616 -1.394 . . . . 52.24 109.616 177.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.86 -45.26 63.99 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.514 0.726 . . . . 71.31 111.891 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.63 -37.35 81.17 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.903 0.774 . . . . 74.41 111.761 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.91 -46.39 74.99 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.561 0.619 . . . . 73.3 110.321 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 10.2 t -57.62 -40.78 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 118.608 0.64 . . . . 73.34 110.747 179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.99 -49.07 77.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.421 1.088 . . . . 75.4 109.824 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -57.53 -52.0 67.2 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.373 -0.83 . . . . 72.31 109.107 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -69.83 -26.21 64.12 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.425 0.557 . . . . 74.34 111.633 -170.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -62.14 -67.66 0.39 Allowed 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.951 -1.129 . . . . 73.0 107.951 168.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 4.4 tppp? -48.8 -37.28 18.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.192 0.997 . . . . 71.14 111.583 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -72.75 28.14 0.06 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.229 1.411 . . . . 74.14 112.935 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.8 m -142.27 157.84 44.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.733 1.613 . . . . 75.11 108.989 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.16 79.49 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 124.364 2.03 . . . . 72.33 108.423 -153.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.401 ' O ' ' HE2' ' A' ' 69' ' ' LYS . 70.0 mt -72.57 -0.2 12.19 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 127.24 2.216 . . . . 74.41 115.187 -165.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.4 t -56.4 -45.6 80.56 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.8 1.182 . . . . 74.43 111.368 -163.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -106.44 64.08 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.687 -0.857 . . . . 72.42 108.687 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.1 t -131.73 124.92 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 N-CA-C 106.87 -1.53 . . . . 75.44 106.87 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.439 ' H ' ' CD ' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -65.24 -54.27 31.8 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.686 0.794 . . . . 72.24 109.134 178.333 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -115.18 71.88 0.78 Allowed 'General case' 0 C--N 1.335 -0.065 0 C-N-CA 125.669 1.587 . . . . 75.32 110.741 -156.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HE2' ' O ' ' A' ' 63' ' ' LEU . 30.1 mmtp -46.95 -36.8 8.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 127.02 2.128 . . . . 71.0 112.916 178.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.31 -50.53 67.47 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 125.329 1.452 . . . . 74.31 111.077 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.9 71.93 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.967 0.507 . . . . 61.04 110.569 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -57.29 -54.96 40.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.625 -0.88 . . . . 72.2 108.625 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.41 -46.92 87.34 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.699 0.4 . . . . 75.14 110.532 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 33.1 t -53.55 -41.82 66.85 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.651 0.78 . . . . 71.31 110.856 177.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.58 -53.41 43.84 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.969 -0.853 . . . . 73.42 110.969 176.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -57.29 -45.38 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 123.222 0.609 . . . . 73.01 109.386 177.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.3 mtt -55.78 -44.33 77.63 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.969 -1.082 . . . . 75.22 111.717 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -57.16 -53.59 56.41 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 118.792 -0.623 . . . . 72.41 109.453 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 m -58.68 -43.26 89.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.351 0.407 . . . . 55.31 110.848 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -61.92 -38.49 88.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.959 -1.088 . . . . 74.04 112.463 176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.72 -11.58 59.84 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.711 -1.243 . . . . 74.02 112.438 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -144.79 90.63 2.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 124.815 1.246 . . . . 71.33 109.481 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.3 50.74 1.65 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.802 1.241 . . . . 75.11 109.568 -178.574 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -147.96 178.55 8.42 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.096 2.158 . . . . 73.3 107.609 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 tptt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.631 1.572 . . . . 75.13 109.502 174.681 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 N-CA-C 109.443 -1.463 . . . . 71.15 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.65 -167.2 1.22 Allowed 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.937 -1.134 . . . . 54.42 107.937 161.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.97 -29.48 70.84 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.714 1.606 . . . . 74.31 112.348 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.46 -36.75 76.56 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.105 0.866 . . . . 73.54 110.264 -171.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -44.39 -53.4 6.86 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.495 1.918 . . . . 74.25 112.495 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.6 tp60 -61.88 -41.93 98.46 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 119.064 -0.493 . . . . 74.15 110.844 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.0 m -67.0 -37.28 83.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.539 -0.541 . . . . 72.14 109.539 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -36.75 82.44 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.281 -0.887 . . . . 72.22 111.295 176.377 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -23.33 67.22 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.365 0.53 . . . . 71.23 111.084 176.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -87.85 -24.28 23.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.962 0.801 . . . . 72.24 112.08 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.38 11.99 1.38 Allowed 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.101 2.161 . . . . 73.35 112.724 -164.486 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 16.12 46.29 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-O 117.954 -1.47 . . . . 71.24 114.168 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.7 mt -119.79 157.02 53.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.773 1.286 . . . . 73.55 113.184 -171.228 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.23 172.49 15.95 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 124.657 3.571 . . . . 74.11 113.178 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -73.45 -43.72 59.72 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.972 1.309 . . . . 74.24 110.278 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.91 -38.48 72.91 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.992 -0.283 . . . . 71.24 111.611 -171.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.3 t -70.74 -52.31 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 127.227 2.211 . . . . 74.15 107.146 176.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.02 -42.25 62.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.889 1.275 . . . . 70.12 112.112 -173.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -52.79 -55.04 25.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 73.53 110.39 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.55 -27.26 58.58 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 118.568 -0.73 . . . . 74.32 111.308 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.3 tp -74.69 -41.63 59.9 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.001 0.92 . . . . 70.35 110.994 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -54.65 -45.97 73.89 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.06 0.944 . . . . 73.53 110.121 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.434 ' CD ' ' HZ3' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -49.63 -37.57 28.6 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 126.999 2.12 . . . . 65.23 112.403 176.758 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.41 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 108.688 -0.856 . . . . 73.55 108.688 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.422 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 19.7 m-85 -80.98 -4.03 53.67 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.884 1.274 . . . . 74.13 112.74 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 42.2 t -85.42 -44.49 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.787 1.176 . . . . 75.55 110.752 175.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.83 -4.29 42.84 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.1 0.778 . . . . 72.53 113.1 -162.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.12 -14.84 64.55 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 125.202 1.382 . . . . 73.13 113.179 -176.33 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 87.9 mt -53.47 -51.66 62.02 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.681 1.593 . . . . 73.55 110.951 -172.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.8 m -136.47 160.09 37.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 O-C-N 123.532 0.52 . . . . 64.32 111.899 168.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.46 159.68 20.72 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 108.504 -0.924 . . . . 74.43 108.504 156.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.422 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 29.1 p80 -59.97 -31.44 69.9 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.934 -0.555 . . . . 73.45 112.088 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.428 ' C ' ' H ' ' A' ' 35' ' ' LEU . 0.1 OUTLIER -94.74 2.05 55.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.373 -0.823 . . . . 73.12 112.331 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -77.34 15.04 0.81 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.583 1.538 . . . . 54.31 112.694 -177.011 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.428 ' H ' ' C ' ' A' ' 33' ' ' SER . 51.3 mt -118.09 -170.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.43 2.692 . . . . 74.15 106.747 -174.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -132.55 172.63 12.25 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 107.48 -1.304 . . . . 74.41 107.48 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -52.76 -36.61 58.22 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.668 0.787 . . . . 63.24 110.825 171.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -54.63 -32.09 58.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.689 -0.632 . . . . 74.24 112.37 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.77 -46.01 22.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.565 0.746 . . . . 64.33 110.963 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.1 mm -55.23 -53.16 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 N-CA-C 107.97 -1.122 . . . . 74.55 107.97 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.43 -45.16 95.49 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 125.102 1.361 . . . . 74.51 110.336 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.58 84.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.329 -0.843 . . . . 74.55 111.918 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.33 -38.83 81.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.239 0.927 . . . . 73.23 111.533 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -61.09 -44.87 96.7 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.145 0.429 . . . . 65.25 109.942 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -69.3 11.99 0.2 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 128.921 2.888 . . . . 73.14 116.1 -165.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -118.33 154.27 32.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.858 1.263 . . . . 73.22 109.55 -175.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.18 176.9 0.1 Allowed 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 122.887 1.327 . . . . 74.51 112.141 155.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -52.23 -65.71 0.51 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.958 2.503 . . . . 73.43 110.313 165.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -32.97 66.51 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.369 0.986 . . . . 62.42 111.973 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.08 -57.24 10.29 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.34 0.971 . . . . 53.25 111.023 168.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.45 -42.87 97.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.659 -0.686 . . . . 74.42 111.297 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.86 -50.26 69.51 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 117.733 -1.127 . . . . 71.54 110.728 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.28 -45.91 69.08 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.632 1.106 . . . . 61.14 111.534 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 55.7 t -53.87 -43.12 56.0 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 124.507 1.123 . . . . 74.31 111.556 175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -72.17 -42.53 65.8 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 122.985 0.514 . . . . 73.12 109.994 -175.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -71.25 -41.09 70.56 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 122.49 0.316 . . . . 75.13 110.834 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -69.31 -17.62 63.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.404 -0.518 . . . . 75.43 111.157 173.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -84.95 -41.45 15.89 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-O 119.418 -0.325 . . . . 70.53 110.324 -179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.434 ' HZ3' ' CD ' ' A' ' 23' ' ' GLU . 6.6 ttmt -70.91 -19.92 62.54 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.881 0.764 . . . . 75.53 111.362 172.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -75.49 48.23 0.43 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.301 1.44 . . . . 71.34 109.753 168.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.4 m -149.58 152.55 35.67 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.629 -1.919 . . . . 75.14 112.411 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -93.37 78.55 4.43 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.271 1.428 . . . . 63.43 107.498 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.401 ' O ' ' HE3' ' A' ' 69' ' ' LYS . 54.5 mt -79.96 -11.86 59.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.181 -0.918 . . . . 74.22 111.064 -168.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 m -53.1 -30.99 39.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.862 2.065 . . . . 75.22 112.07 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.7 m80 -100.21 14.01 32.31 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.352 1.061 . . . . 75.45 113.862 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.2 t -105.17 135.14 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 121.574 -0.704 . . . . 64.55 109.841 -176.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -68.48 0.32 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.37 1.868 . . . . 70.32 110.534 176.046 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -111.61 88.92 2.92 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.34 1.456 . . . . 64.41 109.692 -166.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.401 ' HE3' ' O ' ' A' ' 63' ' ' LEU . 38.9 mmtm -53.21 -31.6 43.87 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.195 1.398 . . . . 73.15 114.07 -172.746 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.53 25.92 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 128.473 2.709 . . . . 74.43 109.085 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.12 89.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.495 0.718 . . . . 73.23 110.146 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.97 -51.03 69.71 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.33 -0.619 . . . . 63.52 109.33 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -57.57 11.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.473 1.109 . . . . 71.45 108.622 -175.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 2.8 t -62.22 -27.1 68.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.637 -0.71 . . . . 65.55 110.583 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.07 -53.69 40.71 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.855 0.741 . . . . 72.14 111.405 168.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -54.52 -49.26 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 118.285 1.042 . . . . 74.44 108.545 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 18.2 mtt -50.59 -54.04 25.82 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.617 0.767 . . . . 73.41 110.744 177.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -62.56 -43.99 97.44 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.802 -0.444 . . . . 74.55 109.802 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -58.6 -47.5 84.12 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.397 0.679 . . . . 70.31 109.607 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -64.06 -44.01 93.74 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.342 0.519 . . . . 74.53 111.924 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -62.44 -50.74 70.26 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.054 -0.721 . . . . 74.53 109.054 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.37 67.88 10.02 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 122.836 1.303 . . . . 72.3 110.011 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -105.24 76.11 1.21 Allowed 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.949 -1.13 . . . . 74.32 107.949 160.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -122.73 88.16 2.88 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 102.765 -3.05 . . . . 70.13 102.765 162.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptt . . . . . 0 C--O 1.261 1.693 0 C-N-CA 128.276 2.631 . . . . 74.52 107.47 -169.752 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.88 0 N-CA-C 109.959 -1.256 . . . . 73.53 109.959 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.34 -176.61 3.03 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.919 1.288 . . . . 72.12 109.588 -168.117 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -50.99 -37.48 45.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.442 1.097 . . . . 74.23 112.459 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -35.27 76.3 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.56 -0.904 . . . . 72.14 108.56 -168.115 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -44.08 -53.39 6.42 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.896 1.678 . . . . 75.23 111.541 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -66.58 -43.5 84.79 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.861 -0.336 . . . . 62.44 110.664 -175.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.5 m -61.65 -38.59 88.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.25 0.62 . . . . 73.23 109.882 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.85 78.63 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.656 1.583 . . . . 75.32 111.692 178.219 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.88 -25.49 65.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.344 0.975 . . . . 71.22 110.135 173.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.89 -11.59 26.47 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.411 1.005 . . . . 74.21 111.905 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.15 13.03 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.829 -1.17 . . . . 74.22 112.184 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 106.36 1.89 38.08 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 124.49 1.043 . . . . 51.42 113.622 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.1 mt -100.17 144.84 29.17 Favored Pre-proline 0 N--CA 1.448 -0.563 0 C-N-CA 124.013 0.925 . . . . 74.51 108.688 -160.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -69.61 164.23 35.16 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 121.639 1.559 . . . . 71.43 110.496 176.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -62.46 -46.81 86.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 -178.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -36.91 71.0 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 114.219 1.192 . . . . 75.34 114.219 -174.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.4 t -73.96 -52.47 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 107.049 -1.463 . . . . 74.11 107.049 174.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.2 -36.09 51.02 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.381 1.073 . . . . 64.32 112.589 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.62 -56.18 15.05 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.531 0.733 . . . . 74.32 110.738 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.81 -32.88 57.93 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 115.839 -0.618 . . . . 71.33 110.389 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.58 -32.25 67.85 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.451 1.1 . . . . 73.32 111.185 -174.401 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.59 -45.17 85.61 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.006 1.322 . . . . 75.44 111.567 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -27.45 66.66 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.473 1.109 . . . . 75.41 112.975 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.77 -17.23 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.66 -0.65 . . . . 75.55 109.509 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -97.99 -0.96 43.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.644 1.178 . . . . 75.32 113.227 175.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.0 t -84.1 -55.6 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.191 -0.943 . . . . 75.23 109.078 175.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.06 36.42 1.21 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.513 1.525 . . . . 61.12 111.469 -151.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 59.28 27.95 63.7 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.378 1.466 . . . . 75.34 115.156 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.417 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 38.5 mt -85.44 -66.02 0.95 Allowed 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.789 0.836 . . . . 74.54 109.207 176.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.99 161.73 35.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.078 0.551 . . . . 72.45 110.789 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.25 158.6 15.51 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.644 2.378 . . . . 73.03 109.588 158.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -58.17 -31.94 67.73 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.204 0.456 . . . . 75.23 111.911 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.4 t -95.21 10.32 36.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.563 0.745 . . . . 72.44 111.959 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -83.03 -12.12 57.49 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 120.679 -1.263 . . . . 74.42 111.193 169.261 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.98 179.4 5.97 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.964 2.106 . . . . 62.31 109.91 174.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 p30 -139.34 -175.92 4.35 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.526 1.13 . . . . 62.45 110.373 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -55.73 -36.48 67.3 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.388 -0.82 . . . . 75.02 111.642 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.0 mtm-85 -66.73 -18.71 65.51 Favored 'General case' 0 C--N 1.338 0.076 0 CA-C-O 118.859 -0.591 . . . . 75.15 111.294 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.72 -51.92 11.64 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.491 1.042 . . . . 60.24 109.93 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.4 mm -60.8 -50.44 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.225 1.41 . . . . 75.15 110.372 -173.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.22 -44.07 76.55 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.626 -0.509 . . . . 74.24 109.626 -174.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.88 82.04 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 122.761 0.424 . . . . 73.14 111.748 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.42 -45.86 80.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.466 0.575 . . . . 75.0 111.259 178.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -20.61 66.14 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.098 -0.953 . . . . 73.12 111.733 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.406 ' CD ' HH21 ' A' ' 81' ' ' ARG . 2.1 mt-10 -85.42 43.7 1.04 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.423 1.465 . . . . 75.13 111.876 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -139.79 156.32 46.82 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.961 -1.087 . . . . 74.43 110.053 170.081 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -84.99 178.13 7.69 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.547 0.739 . . . . 71.44 109.947 165.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -49.41 -56.39 9.81 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.088 1.755 . . . . 72.52 112.04 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -81.41 -34.1 31.78 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.028 -0.42 . . . . 71.42 111.625 -172.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.48 87.07 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 111.544 -0.622 . . . . 71.24 111.544 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.96 69.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.947 1.299 . . . . 73.54 109.567 168.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.8 mt -63.52 -35.27 79.93 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 118.061 -0.971 . . . . 75.11 111.502 -178.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.38 87.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.527 1.058 . . . . 72.43 110.853 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -54.66 -41.64 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 121.618 -0.677 . . . . 74.32 110.444 173.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.7 mt -78.27 -33.19 49.74 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.403 -0.811 . . . . 75.31 110.45 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -54.89 -62.5 1.61 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 107.228 -1.397 . . . . 75.34 107.228 167.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -72.97 -10.06 59.4 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.471 0.915 . . . . 74.42 113.471 -164.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -84.18 -61.31 1.84 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.867 0.867 . . . . 71.23 110.535 172.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.417 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 13.4 ttmt -63.79 -30.1 71.23 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.519 1.054 . . . . 74.23 110.573 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -81.88 57.51 3.48 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 124.381 1.073 . . . . 75.55 109.959 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 75.7 m -153.8 177.31 11.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.055 2.142 . . . . 73.43 107.78 161.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -115.75 105.72 13.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.827 2.051 . . . . 74.54 106.614 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.2 mt -94.59 7.25 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.049 0.939 . . . . 75.54 111.985 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.2 m -53.83 126.47 22.3 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.901 -0.777 . . . . 52.05 108.901 165.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 18.5 m80 59.39 10.26 1.75 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.447 1.899 . . . . 72.51 114.869 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.26 135.79 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 107.357 -1.349 . . . . 72.33 107.357 170.086 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -54.17 -85.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.214 1.806 . . . . 72.11 111.479 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.49 99.96 7.0 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.738 -1.578 . . . . 71.23 106.738 -162.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -62.89 -28.62 70.17 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.586 1.154 . . . . 74.05 111.232 -169.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -51.38 66.64 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.304 1.842 . . . . 64.41 109.26 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.01 -24.41 59.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.736 -0.649 . . . . 73.45 112.085 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -67.07 -56.55 9.57 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 107.053 -1.462 . . . . 72.55 107.053 171.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.73 -52.54 63.56 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.717 1.607 . . . . 75.31 110.118 -173.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 49.5 t -61.96 -28.03 69.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.559 -0.746 . . . . 62.14 110.216 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.67 -47.3 91.24 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.415 -0.803 . . . . 62.13 111.397 173.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.0 t -54.55 -53.68 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 123.944 0.898 . . . . 72.12 109.023 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 2.2 mtt -56.2 -50.1 72.18 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.015 0.526 . . . . 75.04 110.97 -178.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -54.22 -51.0 65.85 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.649 -0.5 . . . . 75.01 109.649 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -54.59 -48.5 72.08 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 124.514 1.134 . . . . 75.13 109.897 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -64.21 -44.11 92.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.183 0.901 . . . . 75.23 112.55 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.406 HH21 ' CD ' ' A' ' 45' ' ' GLU . 3.9 ttt-85 -70.79 -19.42 62.69 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.186 0.903 . . . . 75.21 111.457 178.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -129.96 65.68 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 122.823 1.297 . . . . 73.11 108.944 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 21.7 ptt85 -99.25 5.24 46.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.51 -1.223 . . . . 75.42 112.447 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -83.15 30.59 0.45 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.481 1.513 . . . . 74.44 112.55 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 tppt? . . . . . 0 C--O 1.246 0.913 0 C-N-CA 126.686 1.995 . . . . 75.31 107.637 -166.819 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.449 0 N-CA-C 110.595 -1.002 . . . . 73.52 110.595 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.45 ' C ' ' H ' ' A' ' 4' ' ' ASN . 0.9 OUTLIER -137.11 -167.87 2.18 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.544 -0.539 . . . . 63.53 109.544 -173.161 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.04 23.52 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.606 -1.309 . . . . 73.32 114.32 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . 0.45 ' H ' ' C ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -103.7 -32.97 9.11 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 127.23 2.212 . . . . 72.45 110.457 175.329 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -54.43 -59.38 4.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.516 1.127 . . . . 74.44 112.456 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 tp60 -59.42 -28.8 67.26 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.419 1.088 . . . . 74.21 111.754 -174.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -59.54 -40.52 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.0 0.92 . . . . 65.15 109.509 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.91 -39.38 87.38 Favored 'General case' 0 C--N 1.342 0.27 0 O-C-N 121.672 -0.642 . . . . 70.44 110.97 177.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -64.41 -20.83 66.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.666 -0.683 . . . . 72.33 110.373 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.55 -6.02 41.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.508 1.123 . . . . 73.42 110.814 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.78 15.27 5.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 119.3 -2.125 . . . . 71.35 112.306 -175.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.94 11.84 64.68 Favored Glycine 0 CA--C 1.526 0.772 0 O-C-N 121.029 -1.044 . . . . 73.24 113.547 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 61.6 mt -116.06 160.7 34.44 Favored Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 118.861 1.331 . . . . 72.11 113.507 -161.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.14 172.97 12.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.463 2.775 . . . . 61.05 111.557 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -70.54 -48.0 57.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 118.402 -0.809 . . . . 74.21 110.349 169.574 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -53.91 -36.1 62.37 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.271 0.841 . . . . 73.32 113.271 -163.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -70.67 -55.39 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 C-N-CA 127.889 2.475 . . . . 74.03 107.978 177.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.12 -41.09 16.83 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.83 1.252 . . . . 72.32 112.162 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -61.63 -21.52 64.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.957 1.466 . . . . 74.44 114.957 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.93 -21.23 11.24 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.568 0.543 . . . . 74.01 112.343 170.358 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.97 -28.11 65.27 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.214 1.006 . . . . 74.34 111.449 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -52.08 -45.83 64.94 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.292 1.437 . . . . 70.15 111.7 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -65.1 -27.98 69.13 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 127.288 2.235 . . . . 74.35 114.124 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.1 mm -57.48 -32.94 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.144 -0.687 . . . . 70.14 109.144 176.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -82.42 -49.92 9.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.4 1.08 . . . . 71.51 110.088 177.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.6 t -51.74 -41.83 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.495 0.718 . . . . 71.51 112.195 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.2 7.82 3.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.694 1.198 . . . . 71.12 112.113 -171.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.74 -2.27 59.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.119 0.866 . . . . 65.13 113.036 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 59.6 mt -66.61 -52.11 48.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 124.136 0.974 . . . . 72.12 109.353 -172.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 30.7 m -132.64 162.84 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.721 1.008 . . . . 74.42 113.721 179.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -99.64 155.68 17.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.412 1.485 . . . . 70.43 109.271 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -70.34 -12.55 61.66 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.466 0.913 . . . . 72.33 113.466 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.3 m -118.63 18.4 13.46 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.576 1.15 . . . . 54.02 111.916 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -68.84 -30.09 68.55 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.311 -0.868 . . . . 71.13 110.228 169.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.07 127.29 32.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.067 1.347 . . . . 73.21 108.902 -175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -83.53 164.08 20.03 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.431 -1.322 . . . . 70.4 107.431 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -44.6 -44.2 8.71 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.067 2.147 . . . . 71.02 113.263 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -51.07 -38.18 50.07 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.876 1.27 . . . . 73.1 113.368 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -84.28 -28.1 27.4 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.111 0.965 . . . . 73.32 111.604 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.0 mm -67.6 -45.24 85.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 109.493 -0.558 . . . . 74.44 109.493 176.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -57.92 -49.09 77.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 109.398 -0.593 . . . . 63.34 109.398 172.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.28 77.59 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 118.756 -0.64 . . . . 73.01 111.419 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.9 mt -56.64 -51.54 68.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 120.197 1.362 . . . . 74.41 112.688 173.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -58.06 -17.12 15.73 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.565 0.95 . . . . 74.11 113.565 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.64 -20.63 53.49 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 120.517 1.508 . . . . 72.3 114.819 -170.548 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -94.95 160.93 14.36 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.168 0.985 . . . . 63.31 110.979 -168.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -85.09 178.86 7.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.915 1.286 . . . . 73.24 110.794 166.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -36.54 66.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.72 1.608 . . . . 65.22 113.628 -172.731 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.13 -34.34 10.79 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.269 1.427 . . . . 74.13 109.929 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.31 -43.49 97.25 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.016 -0.834 . . . . 54.2 111.016 178.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.26 81.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.874 1.27 . . . . 72.23 109.783 173.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 mp -61.96 -30.82 71.18 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.939 0.895 . . . . 74.34 111.727 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.75 82.48 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.312 0.96 . . . . 74.31 111.654 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -55.07 -41.06 57.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 109.134 -0.691 . . . . 64.42 109.134 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.55 -51.29 29.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 118.78 -0.629 . . . . 72.01 110.42 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.62 -20.72 65.9 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.038 0.535 . . . . 74.44 112.41 -174.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -87.68 -40.01 14.52 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.636 0.375 . . . . 64.23 110.937 171.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . 0.42 ' CZ ' ' HB2' ' A' ' 73' ' ' LEU . 61.4 t80 -77.16 -36.1 55.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.554 0.946 . . . . 74.13 113.554 -173.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.18 -37.77 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.711 -1.243 . . . . 72.44 109.218 169.422 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -83.44 2.22 37.74 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.123 2.169 . . . . 71.1 112.112 -173.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m -82.61 152.29 25.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.622 1.201 . . . . 73.33 111.914 174.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -83.29 53.81 2.6 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.439 2.296 . . . . 73.42 109.19 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.44 -0.49 12.68 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.843 1.423 . . . . 74.12 114.843 -163.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.4 m -58.06 -59.71 4.85 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.842 1.201 . . . . 73.2 110.479 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -84.8 53.08 2.59 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.385 1.074 . . . . 74.2 110.389 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.4 t -133.23 121.06 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 106.709 -1.589 . . . . 62.03 106.709 170.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.45 -56.54 4.36 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.29 0.95 . . . . 74.3 109.612 169.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -77.05 72.82 3.62 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.02 1.328 . . . . 74.12 110.705 -172.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -57.79 -39.02 76.54 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.994 -0.441 . . . . 74.21 112.052 -176.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.87 -52.72 55.08 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 127.839 2.456 . . . . 70.22 108.457 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.29 79.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.907 -0.588 . . . . 74.34 110.843 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -62.61 -50.37 71.52 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 109.339 -0.615 . . . . 74.43 109.339 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.42 ' HB2' ' CZ ' ' A' ' 58' ' ' PHE . 1.3 tm? -59.52 -52.06 67.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.938 0.895 . . . . 73.01 109.819 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.8 t -58.36 -37.93 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.306 -0.861 . . . . 72.11 109.502 -177.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.03 -45.04 95.82 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.557 1.075 . . . . 71.33 113.167 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.47 -39.51 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 119.332 1.566 . . . . 73.41 109.587 174.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 1.6 mtt -62.72 -35.42 79.7 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.287 -1.508 . . . . 74.2 111.285 176.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 15.3 mtpp -62.93 -46.01 89.81 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 118.461 -0.78 . . . . 72.4 111.398 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 t -62.14 -47.85 82.72 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 119.667 1.121 . . . . 71.32 108.414 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -63.81 -32.66 74.24 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.093 1.516 . . . . 73.13 115.093 -170.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -77.94 -29.55 50.02 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.969 1.259 . . . . 74.32 112.308 169.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -129.32 82.35 2.07 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.519 1.128 . . . . 74.33 109.122 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 48.2 ptt85 -131.1 26.67 4.89 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 126.763 2.025 . . . . 72.13 110.137 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -144.09 178.53 7.81 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 125.316 1.446 . . . . 65.2 109.847 -175.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt . . . . . 0 C--O 1.254 1.312 0 CA-C-O 117.111 -1.423 . . . . 70.1 110.875 161.789 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.352 0 N-CA-C 108.576 -1.81 . . . . 61.03 108.576 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 m -97.89 -170.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 123.696 0.798 . . . . 62.02 110.429 -177.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -61.53 -10.14 7.34 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 114.597 1.332 . . . . 72.13 114.597 -175.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -70.69 -43.21 69.51 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 120.305 1.412 . . . . 74.4 108.679 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -47.02 -56.84 5.74 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.65 1.58 . . . . 73.21 112.622 -173.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -59.99 -42.66 94.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.506 0.323 . . . . 73.34 110.958 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -69.83 -36.88 75.96 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 119.03 -0.51 . . . . 75.23 109.734 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -39.42 91.89 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.744 1.156 . . . . 72.1 111.493 175.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 22.1 mt -63.29 -27.47 69.36 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.104 0.561 . . . . 74.4 111.131 176.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -90.94 -29.83 17.22 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.325 0.65 . . . . 75.12 110.965 177.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.68 -15.6 41.53 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.029 2.132 . . . . 63.32 111.661 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.429 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 127.04 4.93 5.86 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-O 117.411 -1.772 . . . . 74.43 114.936 167.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.9 mt -98.78 153.87 37.68 Favored Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 118.795 1.297 . . . . 75.3 111.387 -169.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.48 165.91 29.03 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.932 2.421 . . . . 74.21 111.288 171.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -61.73 -40.37 94.85 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 124.463 1.105 . . . . 72.32 109.981 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -59.01 -51.29 70.71 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 123.913 0.758 . . . . 72.13 110.2 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.5 -50.71 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.904 1.282 . . . . 72.33 107.789 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.37 -41.45 76.24 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.574 0.624 . . . . 74.2 112.373 -176.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.53 -40.19 78.26 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.245 1.018 . . . . 72.22 110.865 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.89 -35.49 32.49 Favored 'General case' 0 C--O 1.231 0.089 0 O-C-N 121.828 -0.545 . . . . 72.1 110.03 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.8 tp -77.52 -36.96 51.92 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.926 -0.559 . . . . 74.4 112.313 -170.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -54.27 -40.9 68.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.773 0.715 . . . . 64.13 111.313 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -58.38 -33.72 69.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 128.32 2.648 . . . . 72.13 111.856 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.7 mm -58.78 -40.13 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 125.039 1.336 . . . . 74.31 109.728 178.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.64 -47.07 16.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.166 0.586 . . . . 73.41 109.98 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 93.1 t -53.68 -46.15 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.678 0.791 . . . . 73.23 111.174 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.74 -1.18 13.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.348 0.87 . . . . 74.41 113.348 -176.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.07 32.23 44.99 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 124.292 0.948 . . . . 73.41 112.355 171.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.59 -85.2 0.07 Allowed 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.826 -1.546 . . . . 74.3 106.826 170.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -103.2 175.92 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.441 1.096 . . . . 71.24 110.194 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.47 15.95 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.785 . . . . 74.43 111.447 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -64.43 -9.1 16.14 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.464 1.105 . . . . 75.4 113.857 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.1 t -124.06 8.79 8.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.213 1.805 . . . . 64.0 110.149 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.9 -15.71 63.12 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.515 0.932 . . . . 74.03 113.515 -167.25 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -101.55 151.0 22.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.901 0.88 . . . . 75.44 111.75 -159.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -81.95 159.3 23.62 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.246 -1.39 . . . . 72.34 107.246 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.13 -28.85 69.93 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.702 -0.624 . . . . 74.4 112.515 -174.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.367 -0.833 . . . . 75.13 112.261 175.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.33 -30.05 60.18 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.969 -0.382 . . . . 74.24 109.969 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mm -64.99 -53.02 46.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.097 -0.705 . . . . 73.14 109.097 170.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.27 -47.38 84.61 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.237 1.015 . . . . 75.15 111.062 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.13 69.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.05 -0.406 . . . . 75.23 111.7 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.7 mt -56.95 -44.85 82.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.597 0.635 . . . . 63.43 111.816 171.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.429 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.4 OUTLIER -54.46 -20.13 7.01 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.566 1.146 . . . . 75.1 113.509 173.668 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -79.8 -14.45 58.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 120.363 1.438 . . . . 73.44 112.508 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.9 168.28 12.53 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.739 1.616 . . . . 64.01 109.557 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -96.1 -172.84 2.65 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.293 1.837 . . . . 72.34 109.952 165.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.87 -67.56 0.24 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 127.313 2.245 . . . . 73.41 111.386 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -61.84 -36.76 82.14 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.198 0.599 . . . . 72.03 110.811 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.46 -74.7 0.26 Allowed Glycine 0 C--N 1.338 0.673 0 C-N-CA 124.98 1.276 . . . . 73.12 110.517 172.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.24 -44.02 92.36 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.802 1.241 . . . . 70.24 111.938 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -61.05 -37.25 81.97 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.099 0.959 . . . . 73.11 110.209 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.25 81.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.83 0.741 . . . . 71.31 111.175 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 3.2 t -59.02 -23.31 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 CA-C-N 118.791 0.723 . . . . 73.33 111.089 178.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -74.81 -46.5 36.36 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 120.392 -1.442 . . . . 74.0 110.298 174.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.48 60.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.911 0.884 . . . . 74.12 111.549 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.97 -25.97 24.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.746 0.308 . . . . 73.21 111.748 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -66.54 -30.3 70.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.836 0.854 . . . . 73.21 112.295 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -78.03 -25.65 47.97 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.098 -1.001 . . . . 74.32 111.524 167.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.18 45.22 0.73 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.904 1.282 . . . . 45.34 111.437 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.5 m -160.84 178.63 9.23 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 71.23 110.663 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 64' ' ' SER . 0.0 OUTLIER -127.8 66.72 1.34 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 129.69 3.196 . . . . 53.52 106.579 -146.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.18 7.22 1.04 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.31 1.844 . . . . 74.33 112.861 -167.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 62' ' ' ASP . 31.6 t -68.63 -6.17 24.27 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 128.348 2.659 . . . . 62.3 111.58 178.007 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -131.32 38.11 3.65 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.276 1.03 . . . . 71.42 109.984 169.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.56 123.21 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 121.511 0.672 . . . . 74.42 110.042 166.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -80.27 -60.96 2.13 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.141 -0.936 . . . . 74.21 108.906 168.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -80.21 102.94 9.75 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.975 -0.75 . . . . 64.34 108.975 -171.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -73.89 -28.85 61.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.328 -0.851 . . . . 75.14 111.142 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.5 m -66.36 -55.82 14.04 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 124.172 0.989 . . . . 74.4 110.503 -173.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.99 -35.73 77.59 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.726 1.21 . . . . 75.45 110.17 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -63.89 -48.35 76.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.204 0.526 . . . . 75.33 110.611 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.04 -48.94 79.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.63 0.772 . . . . 73.04 110.213 -177.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 3.6 m -55.12 -34.71 63.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.285 1.434 . . . . 74.02 112.307 170.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -60.46 -48.33 86.71 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.145 0.879 . . . . 72.25 111.064 176.804 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.6 t -61.48 -43.93 97.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 117.548 0.674 . . . . 74.45 109.324 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 31.2 mtt -53.76 -45.51 70.64 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 121.095 -1.003 . . . . 73.35 110.19 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -67.66 -29.51 68.82 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.035 -0.983 . . . . 64.11 112.722 -168.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 15.1 t -72.8 -49.36 31.07 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.351 1.432 . . . . 54.53 108.514 169.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -61.38 -33.53 73.83 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.846 -1.159 . . . . 73.21 113.774 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 -7.16 59.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.341 1.056 . . . . 73.24 112.368 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -137.33 75.25 1.52 Allowed 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.458 1.503 . . . . 72.35 109.303 177.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -111.8 89.08 2.96 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 106.025 -1.843 . . . . 73.34 106.025 165.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -87.37 86.03 7.21 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 104.011 -2.589 . . . . 74.23 104.011 164.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.488 ' HE3' ' HA ' ' A' ' 85' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.129 0 N-CA-C 105.327 -2.101 . . . . 72.43 105.327 -170.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.221 0 N-CA-C 109.981 -1.248 . . . . 73.42 109.981 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.416 ' H ' ' CG ' ' A' ' 22' ' ' ASP . 3.5 t -140.83 -154.55 0.52 Allowed 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.118 2.567 . . . . 64.44 107.544 -164.159 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -59.25 -26.37 64.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.161 0.584 . . . . 75.22 111.978 177.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.73 -37.21 67.82 Favored 'General case' 0 C--O 1.227 -0.097 0 CA-C-N 118.539 0.609 . . . . 75.42 110.009 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -49.39 -57.95 6.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.1 1.36 . . . . 51.2 112.643 -166.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -64.28 -35.91 82.39 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 118.821 0.737 . . . . 72.22 112.03 -177.101 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -38.03 77.11 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.467 -0.568 . . . . 62.1 109.467 -178.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.69 -43.13 99.59 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.6 1.16 . . . . 63.2 109.73 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 59.5 mt -62.35 -16.33 53.76 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.596 -0.69 . . . . 55.1 112.583 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -104.6 -6.81 20.16 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.242 1.417 . . . . 63.14 112.171 176.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.02 13.6 2.66 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.447 1.899 . . . . 74.44 112.693 -168.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.84 4.36 58.98 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.307 1.432 . . . . 44.42 112.43 -171.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -102.81 158.0 32.62 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 118.727 1.264 . . . . 74.41 110.55 -162.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.01 -164.42 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.733 1 C-N-CA 126.304 4.67 . . . . 74.42 112.916 172.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.77 -54.98 4.19 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 120.379 -1.451 . . . . 74.44 109.599 161.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -50.42 -48.98 55.98 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.412 1.085 . . . . 74.51 113.818 -164.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.81 -46.9 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 125.175 1.39 . . . . 51.44 107.696 -173.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.14 -38.3 68.04 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.476 0.58 . . . . 75.03 111.313 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.73 -16.78 62.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.09 1.145 . . . . 75.54 114.09 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.5 2.25 16.24 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.873 1.215 . . . . 74.2 113.346 170.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -103.55 -34.23 8.74 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.7 1.2 . . . . 74.0 111.058 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.416 ' CG ' ' H ' ' A' ' 2' ' ' SER . 10.0 t70 -56.32 -40.71 74.84 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.272 0.487 . . . . 75.45 110.997 176.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.62 -44.7 9.12 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 128.908 2.883 . . . . 74.35 112.357 174.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -66.8 -19.8 26.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 74.32 110.23 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -100.37 -13.19 18.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.428 1.091 . . . . 75.25 112.637 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.5 t -89.06 -30.14 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.328 1.051 . . . . 75.34 111.165 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -85.01 10.76 11.02 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.115 -0.991 . . . . 75.33 112.973 -167.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.62 24.8 76.07 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.177 0.894 . . . . 74.54 113.815 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.0 mt -79.7 -83.75 0.1 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.229 2.212 . . . . 75.31 107.032 168.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.63 165.99 15.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 123.685 0.794 . . . . 54.51 112.931 -170.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.89 155.01 24.32 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.145 1.378 . . . . 75.13 109.436 164.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -76.1 -12.97 60.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.312 -0.851 . . . . 72.34 113.172 -175.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.1 m -124.91 36.15 4.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.169 1.788 . . . . 75.14 110.364 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -81.57 15.04 2.25 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 120.981 -1.075 . . . . 75.15 112.88 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -113.25 177.17 4.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.276 -1.515 . . . . 72.41 111.077 -163.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -112.81 160.4 18.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.46 1.104 . . . . 75.21 109.232 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.3 -45.23 72.52 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.277 1.031 . . . . 74.11 109.428 173.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtt85 -58.87 -25.96 63.81 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.939 0.896 . . . . 74.15 111.685 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.93 -45.09 29.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.894 0.77 . . . . 72.04 109.557 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.1 mm -58.47 -40.39 78.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.953 0.901 . . . . 75.31 109.394 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.73 -38.64 91.3 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.632 0.651 . . . . 72.03 110.188 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.14 -33.45 65.51 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.59 1.156 . . . . 74.34 111.536 -173.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.16 -46.09 79.42 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.179 0.899 . . . . 74.2 112.791 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -22.77 64.41 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.842 0.457 . . . . 74.41 111.824 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -75.62 -12.35 60.19 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 113.136 0.791 . . . . 75.0 113.136 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -88.81 164.52 15.18 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 119.614 1.097 . . . . 74.0 109.703 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -101.73 -175.84 2.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 125.347 1.459 . . . . 75.44 109.42 169.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -46.25 -58.58 3.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.527 1.531 . . . . 72.21 112.633 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.64 -46.15 83.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 108.186 -1.042 . . . . 73.22 108.186 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.83 -52.38 53.54 Favored Glycine 0 C--N 1.341 0.843 0 N-CA-C 111.3 -0.72 . . . . 62.23 111.3 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.97 91.83 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.557 0.743 . . . . 53.41 110.908 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.0 mt -61.74 -40.12 93.96 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.46 0.573 . . . . 75.34 111.186 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -65.3 -41.33 94.21 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.148 0.431 . . . . 74.1 111.419 178.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.44 -41.81 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.594 0.758 . . . . 75.43 109.681 175.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.77 -41.9 64.55 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.185 0.594 . . . . 72.4 110.452 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -54.9 -52.15 63.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.68 -0.859 . . . . 75.23 108.68 175.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -68.11 -34.13 75.81 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 119.239 -0.984 . . . . 74.34 110.26 -172.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -65.35 -53.84 37.74 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.856 0.462 . . . . 63.42 110.188 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.29 -41.8 76.5 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.003 0.819 . . . . 75.21 110.002 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.37 16.22 6.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.72 0.637 . . . . 75.22 112.72 -175.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.18 165.82 11.52 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.248 -1.532 . . . . 75.21 112.563 -179.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -88.61 93.21 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.587 -1.642 . . . . 75.52 110.333 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -87.83 53.62 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.838 1.255 . . . . 75.43 110.166 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 p -61.94 83.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.729 2.412 . . . . 75.43 112.279 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.3 m80 51.46 33.55 10.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.365 1.466 . . . . 74.25 112.38 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -52.16 111.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 127.111 2.164 . . . . 63.42 110.55 179.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -55.17 37.44 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.724 -0.61 . . . . 74.15 112.576 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -114.05 84.3 2.01 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.184 1.794 . . . . 72.15 109.292 -167.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.6 mmtm -56.35 -26.83 53.97 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.676 1.191 . . . . 75.25 113.503 -172.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.05 -50.07 57.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 128.32 2.648 . . . . 75.13 109.262 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.8 -38.41 90.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.8 1.24 . . . . 72.04 110.405 -176.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.8 -47.86 83.22 Favored 'General case' 0 C--O 1.23 0.073 0 N-CA-C 109.153 -0.684 . . . . 74.33 109.153 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.3 tp -57.79 -52.59 64.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.336 -0.616 . . . . 63.45 109.336 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.76 -40.32 40.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.904 0.882 . . . . 73.24 111.197 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -44.64 94.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.826 0.727 . . . . 72.25 111.808 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.3 t -65.03 -43.03 96.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 122.087 -0.655 . . . . 64.41 109.799 176.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mtt -57.79 -40.25 79.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 120.799 -1.188 . . . . 62.42 111.323 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -51.82 -59.6 4.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.256 -0.878 . . . . 72.43 109.789 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -62.2 -34.49 76.56 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.898 0.772 . . . . 75.24 111.553 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -68.06 -37.65 81.53 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 120.603 -1.311 . . . . 75.21 113.1 -179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -65.86 -45.9 80.42 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.867 0.758 . . . . 75.11 109.229 166.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -107.08 69.44 0.76 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.484 1.114 . . . . 75.14 110.75 -161.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -123.68 -2.76 8.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.339 0.866 . . . . 74.3 113.339 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -74.59 112.34 10.68 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.573 -1.64 . . . . 72.03 106.573 155.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm . . . . . 0 C--O 1.246 0.876 0 C-N-CA 127.157 2.183 . . . . 74.44 106.639 161.099 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.434 ' HA2' ' OD1' ' A' ' 22' ' ' ASP . . . . . . . . 0 N--CA 1.467 0.753 0 N-CA-C 110.345 -1.102 . . . . 74.03 110.345 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 t -75.35 -170.21 1.16 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.125 0.97 . . . . 61.11 109.031 166.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -35.74 78.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.119 1.368 . . . . 74.43 111.823 167.898 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -58.87 -26.95 64.72 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.065 0.946 . . . . 63.22 112.811 -169.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -45.86 -41.37 11.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.492 1.917 . . . . 74.02 112.575 175.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -70.12 -37.42 75.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.869 -0.586 . . . . 71.32 111.847 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -39.5 92.73 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.977 0.808 . . . . 63.44 109.005 171.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 40.2 mt -59.57 -48.15 82.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.751 0.705 . . . . 75.45 111.66 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 23.5 mt -51.74 -38.96 57.56 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 123.95 0.9 . . . . 74.0 110.854 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -91.92 -6.96 50.46 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.092 0.557 . . . . 64.44 112.026 -174.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.86 2.17 50.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 120.411 -1.431 . . . . 75.33 110.928 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.79 -22.75 8.05 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 124.358 0.98 . . . . 74.43 112.013 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.15 144.82 67.88 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 117.675 0.737 . . . . 72.04 110.936 -159.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.47 156.23 61.71 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 C-N-CA 121.708 1.606 . . . . 74.02 109.361 164.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -59.4 -39.97 85.13 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 124.192 0.997 . . . . 71.34 108.83 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -56.11 -45.87 79.33 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 112.193 0.442 . . . . 74.13 112.193 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.69 -50.38 50.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 108.254 -1.017 . . . . 72.15 108.254 176.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.92 -42.71 65.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.466 0.706 . . . . 63.11 111.7 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -59.24 -55.6 32.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 119.127 0.876 . . . . 74.03 110.935 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.14 -30.51 69.67 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 118.593 -0.718 . . . . 74.05 111.166 -175.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.4 tp -76.39 -36.91 57.84 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.505 1.122 . . . . 72.12 110.609 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.434 ' OD1' ' HA2' ' A' ' 1' ' ' GLY . 1.1 t70 -55.5 -39.57 70.64 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.749 0.82 . . . . 64.25 110.755 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -29.63 69.41 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.783 1.633 . . . . 74.04 112.299 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.4 mt -65.33 -33.07 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 107.662 -1.236 . . . . 75.42 107.662 -176.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.432 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 11.0 m-85 -90.48 7.82 36.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.382 1.873 . . . . 75.24 112.951 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -99.15 -38.01 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 O-C-N 121.186 -0.947 . . . . 61.41 109.444 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.34 -17.45 59.4 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.25 0.833 . . . . 72.11 113.25 -165.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.4 13.18 52.58 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.413 0.551 . . . . 64.02 111.819 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.9 mt -78.06 -55.29 5.4 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.709 -0.848 . . . . 75.35 108.709 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 21.3 m -140.16 156.54 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.42 0.688 . . . . 74.33 109.873 174.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.17 158.66 26.25 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.236 -0.653 . . . . 74.12 109.236 164.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.432 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 19.2 p80 -62.26 -24.62 67.37 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.786 -0.571 . . . . 74.21 112.14 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.6 t -107.7 15.74 24.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.173 0.989 . . . . 75.01 111.793 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.38 -23.88 64.72 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.591 -1.318 . . . . 73.32 110.989 171.827 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.18 173.95 9.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.015 1.726 . . . . 73.11 110.599 -174.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.32 175.37 9.0 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.205 1.002 . . . . 73.35 108.87 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -44.83 -45.14 9.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.443 2.297 . . . . 73.11 114.589 -171.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -60.75 -21.85 63.43 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.958 0.799 . . . . 64.43 112.063 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -58.73 4.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.218 1.007 . . . . 53.21 109.993 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.43 ' H ' HD13 ' A' ' 40' ' ' ILE . 4.4 mp -56.31 -44.89 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.42 1.088 . . . . 71.23 110.924 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -55.45 -48.64 74.17 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.697 1.199 . . . . 75.32 110.987 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.42 86.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 118.408 -0.806 . . . . 72.42 111.101 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -52.95 -37.59 61.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.767 -0.635 . . . . 74.34 111.338 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -29.48 67.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.211 0.819 . . . . 74.22 113.211 174.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -66.99 -21.4 65.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 119.72 1.146 . . . . 71.24 111.366 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -88.27 143.58 26.94 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.323 1.049 . . . . 74.43 110.928 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -69.04 178.52 2.21 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.734 2.013 . . . . 70.13 111.292 163.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -51.14 -65.28 0.58 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.797 2.039 . . . . 73.23 110.939 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -37.67 76.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.723 0.809 . . . . 73.13 110.603 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.74 -37.05 66.84 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 111.431 -0.667 . . . . 44.11 111.431 -175.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.52 91.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.587 0.693 . . . . 71.12 109.496 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 mt -56.41 -37.86 70.76 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.949 -0.47 . . . . 73.02 111.038 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.53 81.47 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.291 0.496 . . . . 72.35 112.271 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 37.4 t -51.45 -38.31 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.801 0.728 . . . . 75.22 110.277 173.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.1 mt -73.2 -53.54 10.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.331 0.653 . . . . 75.01 109.923 -176.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.1 -43.18 73.79 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 124.001 0.813 . . . . 64.25 110.106 -176.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -69.11 -31.13 69.62 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 123.036 0.21 . . . . 70.34 110.957 -174.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -73.3 -49.46 27.38 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.148 0.979 . . . . 75.32 111.461 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -60.71 -38.76 86.15 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.876 1.216 . . . . 65.35 109.733 175.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.31 5.36 20.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.137 0.791 . . . . 74.33 113.137 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.6 p -74.44 170.65 15.24 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 119.929 1.24 . . . . 73.22 111.224 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -96.86 98.73 10.35 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.955 -1.128 . . . . 72.34 107.955 173.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.1 mt -98.99 25.39 6.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.482 1.113 . . . . 75.34 109.848 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 t -67.07 -38.86 86.51 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.26 -0.9 . . . . 72.43 111.16 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -130.97 23.65 4.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.046 0.938 . . . . 73.44 112.396 -170.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.45 165.57 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.393 1.077 . . . . 73.33 110.016 165.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -122.32 -85.68 0.65 Allowed 'General case' 0 C--O 1.234 0.256 0 N-CA-C 106.577 -1.638 . . . . 73.34 106.577 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.58 116.88 14.69 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.889 -1.152 . . . . 75.43 107.889 176.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -64.15 -35.92 82.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.621 -0.674 . . . . 75.15 111.865 -179.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.11 -52.51 65.22 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 126.193 1.797 . . . . 74.03 108.095 -176.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.54 -25.01 67.82 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.357 -0.838 . . . . 72.35 112.768 -175.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -74.85 -52.88 10.2 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.715 -0.846 . . . . 74.44 108.715 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.425 ' CD1' ' HE3' ' A' ' 77' ' ' MET . 0.7 OUTLIER -61.28 -52.99 62.4 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.49 1.138 . . . . 75.04 109.109 -173.476 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.0 t -62.96 -20.75 65.55 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.407 -1.27 . . . . 74.12 110.741 -176.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.94 -53.44 5.79 Favored Glycine 0 C--N 1.34 0.787 0 CA-C-O 117.408 -1.773 . . . . 73.15 110.878 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 53.7 t -47.72 -50.58 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.148 1.474 . . . . 73.03 109.327 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.425 ' HE3' ' CD1' ' A' ' 73' ' ' LEU . 6.6 mtt -53.46 -50.98 64.15 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 119.6 -0.238 . . . . 72.13 111.007 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HA ' HH11 ' A' ' 81' ' ' ARG . 3.5 ttmt -59.67 -47.44 85.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.612 -0.709 . . . . 74.45 110.621 -177.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.1 m -60.2 -38.58 83.73 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.134 -0.936 . . . . 61.02 111.064 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.89 -58.18 9.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.871 1.214 . . . . 74.31 111.1 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.431 HH11 ' HA ' ' A' ' 78' ' ' LYS . 6.2 ptp85 -57.88 -35.41 70.94 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 118.033 -0.984 . . . . 73.31 110.974 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -107.35 36.75 2.6 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.662 1.985 . . . . 71.35 114.381 -172.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 72.62 2.07 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.308 -1.495 . . . . 71.33 110.98 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.08 88.53 5.69 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.309 -2.108 . . . . 73.35 105.309 164.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 mmmt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 116.126 -1.892 . . . . 72.51 108.241 -146.392 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.372 0 N-CA-C 109.74 -1.344 . . . . 61.14 109.74 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 t -127.36 -177.29 4.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.288 1.994 . . . . 74.1 111.196 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.48 -20.14 64.58 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 113.555 -1.657 . . . . 62.52 112.794 167.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -74.43 -27.64 60.7 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.591 1.087 . . . . 74.44 111.05 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -44.95 -53.46 7.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.324 1.45 . . . . 74.1 111.913 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -64.32 -37.8 88.79 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.97 0.508 . . . . 74.12 112.204 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 m -64.19 -48.78 74.61 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 108.895 -0.78 . . . . 70.24 108.895 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.0 mp -58.87 -42.71 90.1 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 124.094 0.958 . . . . 74.44 110.846 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.8 mt -56.59 -27.26 57.59 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.707 0.803 . . . . 74.43 111.034 177.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -101.05 -3.2 29.78 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.002 0.819 . . . . 54.31 112.764 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -89.5 10.31 23.29 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 120.522 -1.361 . . . . 74.52 112.679 -169.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.85 3.43 42.63 Favored Glycine 0 CA--C 1.527 0.804 0 C-N-CA 125.331 1.443 . . . . 74.23 113.072 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.3 mt -111.68 157.73 38.54 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 118.785 1.293 . . . . 72.13 111.201 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.43 167.89 18.77 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.169 2.579 . . . . 73.32 111.657 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -66.01 -47.42 74.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 124.615 1.166 . . . . 54.22 109.177 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -43.27 83.17 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.525 -0.47 . . . . 74.44 111.155 -172.503 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.77 -53.84 39.57 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.566 -1.272 . . . . 71.24 107.566 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.22 -51.34 45.05 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.334 1.054 . . . . 64.34 111.628 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -55.18 -45.37 75.79 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.805 0.73 . . . . 73.41 111.536 -178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -38.85 51.72 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 118.449 -0.786 . . . . 72.41 111.031 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.19 -39.24 71.93 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 126.451 1.9 . . . . 73.31 111.099 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.01 -42.26 79.99 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.981 1.313 . . . . 73.14 111.075 -177.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -64.93 -22.66 67.04 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.319 1.448 . . . . 74.34 113.03 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.4 mt -70.76 -22.25 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 O-C-N 121.068 -1.02 . . . . 74.0 108.571 176.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.77 23.55 11.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.683 1.993 . . . . 72.33 112.126 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 91.8 t -115.45 -38.92 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.269 1.028 . . . . 72.5 110.419 174.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.28 5.55 14.4 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.511 -0.743 . . . . 71.1 112.945 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 -8.84 76.93 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 127.329 2.395 . . . . 71.51 113.539 177.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.617 ' CD1' ' HZ3' ' A' ' 59' ' ' LYS . 58.3 mt -61.96 -60.84 3.03 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 126.419 1.887 . . . . 72.42 110.084 -165.495 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 m -130.34 179.16 4.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.257 -0.883 . . . . 73.11 109.88 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -122.71 164.69 17.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.465 1.106 . . . . 74.54 109.13 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -59.7 -12.09 6.35 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.08 1.141 . . . . 74.43 114.08 -173.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.63 23.99 4.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.01 1.324 . . . . 72.14 112.564 -177.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -73.84 30.66 0.08 Allowed 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.591 -1.318 . . . . 74.52 111.382 169.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.6 mt -125.18 -177.48 3.88 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.079 2.152 . . . . 72.0 110.353 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -137.06 163.03 31.73 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.04 -1.467 . . . . 64.22 107.04 172.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -55.93 -37.99 69.68 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.647 1.579 . . . . 74.4 111.51 -175.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.0 ptt180 -55.53 -36.69 67.02 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.659 0.985 . . . . 71.4 113.659 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.07 -40.5 38.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.413 -0.588 . . . . 72.43 109.413 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.3 mm -60.78 -44.1 96.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 122.995 0.518 . . . . 73.23 110.268 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.46 -50.92 65.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.466 0.706 . . . . 65.31 109.819 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.24 71.15 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 117.644 -1.17 . . . . 63.04 112.68 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.85 -46.39 90.76 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.973 1.261 . . . . 73.2 110.066 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -40.94 98.88 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 118.022 0.374 . . . . 71.31 110.389 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -76.73 43.51 0.34 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.485 1.114 . . . . 65.22 111.999 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -138.41 149.59 45.66 Favored 'General case' 0 C--O 1.233 0.193 0 O-C-N 121.087 -1.008 . . . . 72.42 108.317 162.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -68.62 163.66 23.21 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.331 1.452 . . . . 73.12 110.358 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -47.83 -70.99 0.08 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 127.455 2.302 . . . . 71.12 110.864 -179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -70.52 -23.28 62.61 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.28 -0.263 . . . . 74.12 111.24 -172.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.85 -60.74 5.83 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 109.938 -1.265 . . . . 73.01 109.938 176.305 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -47.63 -40.94 20.93 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.582 1.953 . . . . 63.24 111.884 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -46.86 83.29 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.668 1.187 . . . . 74.43 111.576 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.71 -45.84 81.6 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.036 0.446 . . . . 73.32 109.837 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.74 -37.89 62.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 123.283 0.633 . . . . 74.44 110.975 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.56 -45.37 75.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.192 -0.942 . . . . 73.4 109.938 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -56.04 -49.73 72.91 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.98 -0.748 . . . . 74.44 108.98 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -65.41 -28.2 69.08 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.14 0.427 . . . . 74.44 111.878 -174.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.86 -33.89 51.95 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.764 0.826 . . . . 71.03 112.943 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.617 ' HZ3' ' CD1' ' A' ' 29' ' ' LEU . 0.1 OUTLIER -63.04 -37.84 88.81 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.82 -1.175 . . . . 72.0 110.005 168.902 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -83.76 52.63 2.32 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.903 2.481 . . . . 74.41 109.995 -175.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.62 170.97 17.88 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.42 1.088 . . . . 71.3 110.457 170.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.46 77.4 1.09 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 125.746 1.619 . . . . 73.21 108.017 -169.561 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.17 49.53 0.69 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.161 1.384 . . . . 74.41 110.977 -175.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -111.12 -21.51 11.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.201 1.8 . . . . 72.22 112.205 -175.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -130.64 16.58 5.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.239 1.016 . . . . 74.22 111.776 176.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.5 t -90.52 104.85 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 107.586 -1.264 . . . . 73.0 107.586 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -58.43 -35.42 72.07 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.709 0.633 . . . . 74.03 112.709 175.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.5 p30 -129.07 78.74 1.87 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.988 0.899 . . . . 63.02 111.472 -170.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 44.0 mmtt -48.26 -40.68 25.46 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.516 1.526 . . . . 72.41 110.445 177.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.6 p -55.22 -61.01 2.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.443 2.697 . . . . 72.23 111.364 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.7 -29.81 70.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 119.111 -0.471 . . . . 73.21 111.278 -177.566 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -63.07 -52.23 63.57 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.466 -0.939 . . . . 72.12 108.466 173.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.84 -47.06 81.2 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.047 1.339 . . . . 74.13 109.836 178.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -27.13 68.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.012 0.925 . . . . 72.42 111.907 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.76 -54.84 6.96 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 109.603 -1.399 . . . . 71.14 109.603 176.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 89.0 t -52.36 -48.14 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.867 0.867 . . . . 74.14 109.562 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 36.2 mtt -50.25 -52.27 37.57 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.908 -1.12 . . . . 74.4 111.237 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.28 89.34 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 118.01 -0.995 . . . . 71.43 111.184 -171.532 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 t -67.74 -28.29 67.51 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.954 1.252 . . . . 74.32 111.178 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.444 ' C ' ' H ' ' A' ' 82' ' ' GLN . 57.7 m-85 -71.32 -46.27 61.06 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.57 1.532 . . . . 74.31 110.612 169.302 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.78 24.71 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.419 -1.426 . . . . 73.13 113.068 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 80' ' ' TYR . 0.0 OUTLIER -132.98 15.23 4.25 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.015 2.126 . . . . 73.32 111.753 174.253 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 72.3 mtp85 -134.65 38.38 3.06 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.095 0.862 . . . . 74.01 111.18 -172.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -81.34 130.76 35.17 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.276 -1.009 . . . . 73.02 108.276 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.333 0 C-N-CA 126.848 2.059 . . . . 74.13 106.307 -173.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.53 0 N-CA-C 110.574 -1.01 . . . . 72.52 110.574 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -69.18 179.73 1.84 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.382 0.61 . . . . 75.45 109.536 157.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -49.48 -35.9 21.21 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.356 1.463 . . . . 75.35 113.002 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.73 -34.6 74.65 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.184 0.993 . . . . 75.45 109.771 -166.344 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -44.77 -54.57 6.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.004 1.322 . . . . 71.33 110.486 176.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -66.56 -31.62 72.45 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.974 -1.013 . . . . 63.45 111.848 -176.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -60.08 -46.73 88.62 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.74 1.155 . . . . 75.44 109.63 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.45 -40.48 95.81 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.206 -0.934 . . . . 74.35 110.963 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.41 -20.09 65.25 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.796 0.725 . . . . 75.11 112.139 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -86.87 -36.78 18.24 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.366 1.066 . . . . 71.24 109.081 175.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.06 64.28 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.599 1.96 . . . . 74.13 113.38 -166.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.87 17.0 2.61 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 119.322 -0.71 . . . . 55.13 113.176 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.3 mt -112.8 148.08 38.55 Favored Pre-proline 0 C--O 1.239 0.509 0 CA-C-N 118.133 0.966 . . . . 71.45 111.96 -156.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.07 154.19 70.89 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.793 2.328 . . . . 74.41 109.112 174.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.0 -40.88 78.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 108.024 -1.102 . . . . 71.15 108.024 -168.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -56.53 18.31 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 123.741 0.65 . . . . 74.21 109.862 -175.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.7 t -58.36 -45.37 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 N-CA-C 108.166 -1.05 . . . . 75.44 108.166 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.24 80.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.367 0.877 . . . . 73.21 113.367 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -55.5 -35.74 65.91 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.6 0.76 . . . . 74.31 111.1 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -91.84 -15.89 27.54 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.232 1.413 . . . . 75.11 111.544 -173.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.45 -38.54 34.4 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 124.787 1.235 . . . . 74.32 111.799 171.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -52.68 -48.2 66.68 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 123.949 0.9 . . . . 64.32 109.628 -171.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -64.91 -5.25 5.67 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.082 2.153 . . . . 75.11 115.092 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.1 mt -90.82 -10.72 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 124.386 1.074 . . . . 75.41 109.544 173.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -109.93 6.29 23.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.218 1.407 . . . . 75.53 113.95 -178.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -120.14 -5.82 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.779 1.232 . . . . 75.54 111.819 -173.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.68 6.22 23.54 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.269 -1.519 . . . . 74.11 112.311 -172.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.19 12.54 84.05 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.181 0.895 . . . . 63.13 113.614 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.69 -65.19 0.89 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.608 1.963 . . . . 73.15 109.628 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -129.84 156.98 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 N-CA-C 113.765 1.024 . . . . 75.44 113.765 171.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.97 149.86 39.21 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 125.605 1.562 . . . . 70.55 109.945 161.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -55.92 -47.96 76.57 Favored 'General case' 0 C--O 1.228 -0.062 0 C-N-CA 123.634 0.773 . . . . 71.42 110.962 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.1 t -83.77 3.2 34.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.346 0.498 . . . . 72.42 112.346 -172.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -67.48 -28.49 67.9 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.763 -1.211 . . . . 72.15 111.911 -174.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.67 155.24 40.82 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.311 -0.625 . . . . 74.52 109.311 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -111.61 167.02 10.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.388 -0.968 . . . . 74.1 108.388 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.16 -37.42 64.43 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.041 0.536 . . . . 74.4 112.313 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -54.84 -39.52 68.66 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.24 0.473 . . . . 73.0 111.828 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.02 -39.28 66.12 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.955 -0.545 . . . . 74.14 110.955 177.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.66 -46.05 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.972 0.805 . . . . 74.23 108.99 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.39 -55.73 30.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.854 1.662 . . . . 74.13 110.298 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.65 76.52 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.852 0.461 . . . . 74.03 111.176 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.49 -52.49 65.18 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.226 1.011 . . . . 73.24 110.642 173.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.53 -18.95 3.19 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 117.575 -1.202 . . . . 63.44 113.6 171.651 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -86.37 -7.13 58.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 121.896 2.134 . . . . 61.4 114.877 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -90.15 -177.34 5.12 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.547 1.521 . . . . 74.11 110.948 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -105.67 173.52 6.28 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 124.971 1.308 . . . . 73.34 108.962 162.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -53.85 -69.87 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 126.065 1.746 . . . . 75.42 111.144 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -68.47 -10.81 57.91 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.86 1.664 . . . . 75.3 111.581 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -74.24 -72.98 0.96 Allowed Glycine 0 C--N 1.339 0.719 0 N-CA-C 108.504 -1.838 . . . . 62.22 108.504 172.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.83 -36.95 49.95 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.142 0.977 . . . . 74.23 112.343 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.73 -44.97 94.82 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.909 0.884 . . . . 75.44 111.137 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.65 92.04 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.822 0.737 . . . . 71.43 111.698 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 57.3 t -56.62 -30.97 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.978 1.311 . . . . 74.21 110.503 -178.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.6 mt -68.19 -45.91 72.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.426 1.49 . . . . 75.51 110.791 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -54.37 -42.62 70.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.247 -0.649 . . . . 75.31 109.247 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -76.91 0.88 19.31 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.738 1.014 . . . . 75.02 113.738 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -110.39 -41.16 4.44 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.786 1.635 . . . . 74.14 111.402 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -28.47 68.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 120.432 -1.417 . . . . 72.2 111.029 175.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -82.59 1.75 36.57 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 118.625 -0.702 . . . . 75.1 112.716 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.5 m -92.45 -176.11 4.21 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 120.341 1.428 . . . . 71.24 111.105 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.99 79.88 1.93 Allowed 'General case' 0 C--O 1.24 0.566 0 C-N-CA 126.024 1.73 . . . . 62.4 109.246 -170.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.533 ' CD2' ' H ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -86.1 -6.43 59.02 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.038 -1.664 . . . . 72.44 113.309 -162.813 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.1 -62.3 1.54 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.585 1.954 . . . . 62.54 111.651 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -86.31 2.04 48.8 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.551 0.74 . . . . 72.14 112.462 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.95 151.58 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.259 -0.901 . . . . 74.12 109.504 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -83.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.414 1.886 . . . . 71.04 108.868 174.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -98.33 117.74 33.41 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 74.44 107.569 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.3 mmtm -56.6 -39.25 73.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.03 0.832 . . . . 70.31 110.859 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -47.38 74.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.631 1.172 . . . . 74.3 110.446 -174.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.29 -23.67 67.09 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.431 -0.507 . . . . 70.14 111.71 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -64.34 -55.49 20.81 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 107.873 -1.158 . . . . 65.4 107.873 173.677 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.98 -50.68 63.65 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.24 1.816 . . . . 73.01 110.559 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.61 -22.01 66.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.113 -0.494 . . . . 74.4 111.835 -177.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.43 -52.09 42.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.214 -1.154 . . . . 74.02 110.214 172.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.4 t -55.3 -46.4 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 123.735 0.814 . . . . 74.01 109.033 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 46.4 mtt -55.37 -41.62 72.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.077 0.769 . . . . 73.42 113.077 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.29 -46.83 85.37 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.932 0.787 . . . . 72.23 109.238 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -57.8 -56.14 25.84 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.065 0.546 . . . . 75.12 109.944 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -55.39 -43.58 75.32 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.976 0.807 . . . . 75.03 111.527 -178.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -3.22 37.17 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.93 -1.106 . . . . 75.04 113.847 -177.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -130.7 79.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.0 1.72 . . . . 73.23 107.714 171.594 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -142.77 105.95 4.58 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.563 2.345 . . . . 75.12 107.252 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -102.11 129.5 48.46 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 106.575 -1.639 . . . . 74.12 106.575 163.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.4 tptp . . . . . 0 C--O 1.253 1.289 0 N-CA-C 103.696 -2.705 . . . . 75.24 103.696 168.445 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.469 ' HA3' ' OD2' ' A' ' 22' ' ' ASP . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 109.691 -1.364 . . . . 73.24 109.691 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -137.97 -168.55 2.37 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.04 0.536 . . . . 73.12 110.012 -163.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -57.21 -29.27 63.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.057 0.943 . . . . 74.23 112.616 -177.11 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -66.86 -37.4 84.37 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 123.424 0.69 . . . . 74.33 109.3 -165.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -46.35 -59.86 2.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.577 0.751 . . . . 72.03 111.132 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -60.91 -45.93 92.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.976 -0.535 . . . . 73.45 112.228 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -68.34 -26.58 65.68 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.385 0.993 . . . . 74.43 110.824 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -35.22 77.3 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 119.857 -1.777 . . . . 73.14 110.339 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.28 -20.39 66.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.529 1.059 . . . . 71.34 111.536 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.06 -17.83 21.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.408 0.683 . . . . 61.22 112.361 175.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.61 9.51 1.39 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.227 1.411 . . . . 71.03 112.448 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.11 17.6 71.6 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.566 1.079 . . . . 33.2 113.096 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -103.76 156.32 35.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.403 1.081 . . . . 73.32 110.684 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.16 160.03 46.19 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.051 3.167 . . . . 74.23 113.062 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -63.88 -45.7 88.19 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.717 0.807 . . . . 74.34 109.248 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -23.67 65.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.901 -1.12 . . . . 74.45 112.353 -168.037 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -70.66 -56.94 9.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 N-CA-C 106.726 -1.583 . . . . 63.13 106.726 168.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.01 -40.21 60.64 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.385 0.993 . . . . 71.04 113.058 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.52 -15.19 57.21 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.52 1.528 . . . . 71.21 113.667 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.3 -18.87 12.4 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.651 1.581 . . . . 73.23 112.108 173.56 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.2 tp -92.42 -29.65 16.17 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 126.15 1.78 . . . . 74.33 111.581 -173.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.469 ' OD2' ' HA3' ' A' ' 1' ' ' GLY . 5.9 t0 -56.97 -43.88 82.09 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 123.495 0.718 . . . . 73.41 110.416 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -34.25 66.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.902 2.081 . . . . 74.25 113.811 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.5 mm -58.85 -20.69 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 123.932 0.893 . . . . 74.33 109.289 178.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . 0.493 ' CD1' ' HA ' ' A' ' 32' ' ' HIS . 39.5 m-85 -104.67 9.53 35.12 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.676 1.59 . . . . 74.12 112.968 177.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -116.21 -32.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.593 1.557 . . . . 75.21 111.068 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.68 24.22 0.89 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.847 0.859 . . . . 74.35 111.19 -176.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.01 80.62 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.98 1.753 . . . . 74.03 113.93 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.462 HD11 ' HE3' ' A' ' 59' ' ' LYS . 2.2 mt -73.78 -63.89 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.873 1.337 . . . . 64.03 110.527 -168.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.55 158.71 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.392 1.077 . . . . 74.12 113.465 -169.45 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.15 13.04 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 127.732 2.413 . . . . 75.03 115.47 -172.187 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.493 ' HA ' ' CD1' ' A' ' 25' ' ' TYR 0.258 6.7 p-80 56.11 -21.77 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.939 2.496 . . . . 71.43 116.604 -161.452 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 23.9 5.55 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.59 1.556 . . . . 74.01 111.409 -177.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -70.15 19.13 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.617 1.967 . . . . 64.23 113.766 -175.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.8 mt -129.22 -171.83 2.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.439 1.496 . . . . 73.32 110.701 -152.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.91 169.74 17.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 126.969 2.107 . . . . 74.0 107.806 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -47.28 -46.03 24.47 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 126.537 1.935 . . . . 73.5 112.423 -169.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -54.97 -29.32 56.62 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.746 0.647 . . . . 74.33 112.746 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.63 -47.81 65.67 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 118.828 -0.606 . . . . 74.04 110.605 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.513 HD11 ' H ' ' A' ' 40' ' ' ILE . 3.6 mp -71.19 -43.46 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 119.024 0.829 . . . . 74.03 109.707 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -67.87 -48.09 67.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 119.129 -0.462 . . . . 62.12 110.456 -173.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -22.5 64.11 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.014 0.825 . . . . 73.34 111.985 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.05 -37.5 77.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.575 1.08 . . . . 74.1 111.847 166.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm -65.82 -25.63 67.31 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.803 0.729 . . . . 74.34 111.544 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -87.77 21.75 2.52 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.422 -0.799 . . . . 70.21 111.976 -167.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -125.37 156.93 37.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.924 -1.11 . . . . 63.32 109.95 175.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -67.94 169.71 9.46 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.702 -0.681 . . . . 71.23 109.534 155.696 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -50.27 -58.86 4.7 Favored 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 125.727 1.611 . . . . 73.51 109.603 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -4.04 35.03 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.317 1.047 . . . . 65.21 112.26 -174.062 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -86.12 -57.09 2.18 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 109.055 -1.618 . . . . 74.1 109.055 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.99 89.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.94 1.296 . . . . 73.32 112.233 -175.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.74 -44.29 93.85 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 119.18 0.9 . . . . 73.34 110.572 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.65 -43.89 93.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 120.571 -0.451 . . . . 63.5 111.226 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 61.1 t -54.34 -41.11 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.285 -0.884 . . . . 71.13 110.264 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.54 -52.22 58.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.4 -0.593 . . . . 74.3 109.4 -178.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -58.18 -33.67 69.5 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 123.759 0.662 . . . . 75.12 109.609 -174.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -91.87 -27.77 17.73 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.69 0.677 . . . . 72.53 111.745 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -62.08 -20.96 64.56 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.469 0.652 . . . . 73.2 110.971 164.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.462 ' HE3' HD11 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -102.57 -19.47 14.84 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 113.594 0.961 . . . . 75.0 113.594 176.322 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -80.5 59.99 3.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.059 1.744 . . . . 60.51 107.003 158.598 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.1 m -158.1 163.72 37.35 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.526 1.531 . . . . 71.1 107.708 170.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -105.92 128.91 54.09 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 105.137 -2.171 . . . . 74.51 105.137 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.0 mt -116.35 44.83 1.9 Allowed 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.701 2.4 . . . . 75.22 109.004 -172.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.3 m -59.08 95.58 0.03 OUTLIER 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.726 0.81 . . . . 75.42 111.395 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 49.14 35.05 6.56 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 128.309 2.643 . . . . 75.44 113.485 177.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -60.02 111.53 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.682 -1.229 . . . . 74.54 107.682 169.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -67.23 -40.12 86.31 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.705 -1.247 . . . . 63.34 109.762 168.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -78.32 50.45 0.93 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.201 1.4 . . . . 60.11 112.514 -170.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.1 mmtm -52.71 -39.93 62.49 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 120.946 -1.096 . . . . 74.44 112.196 -177.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.7 p -66.13 -53.35 38.91 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.325 1.05 . . . . 72.53 110.14 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -38.45 84.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.1 -0.476 . . . . 74.13 110.723 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -62.58 -49.55 74.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 108.93 -0.767 . . . . 75.21 108.93 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.68 -50.61 70.46 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.89 0.876 . . . . 73.34 109.795 -177.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.405 ' HA ' ' SD ' ' A' ' 77' ' ' MET . 4.5 t -64.93 -21.82 66.89 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.106 0.962 . . . . 70.13 110.943 -178.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.37 -53.46 13.29 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 126.063 1.792 . . . . 71.51 110.795 169.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -55.81 -47.93 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.736 1.268 . . . . 73.23 108.652 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.405 ' SD ' ' HA ' ' A' ' 74' ' ' CYS . 44.7 mtt -48.05 -56.9 6.63 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.95 0.9 . . . . 72.22 110.839 172.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -59.13 -43.53 92.0 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.882 -0.784 . . . . 73.23 108.882 -175.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -60.99 -35.34 76.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 119.244 -0.408 . . . . 73.32 111.647 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -65.83 -42.53 90.41 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.558 -1.339 . . . . 73.24 112.71 175.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -79.35 -15.91 57.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 118.407 -0.806 . . . . 73.33 113.108 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -142.41 88.74 2.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.535 1.934 . . . . 73.51 107.327 -174.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -124.89 3.04 8.1 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.331 1.852 . . . . 70.4 112.898 -168.494 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.97 118.72 5.25 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.713 1.205 . . . . 65.23 108.226 169.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.255 1.362 0 N-CA-C 105.041 -2.207 . . . . 74.13 105.041 173.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.445 0 N-CA-C 110.19 -1.164 . . . . 42.25 110.19 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.48 -173.41 2.52 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.743 1.217 . . . . 41.109999999999999 111.684 -169.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -44.18 -45.04 8.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.162 2.185 . . . . 73.140000000000001 110.899 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.73 -34.44 78.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.632 1.173 . . . . 75.310000000000002 110.649 -170.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.62 -50.04 69.05 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.17 0.988 . . . . 63.450000000000003 112.133 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.97 -40.59 91.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.082 -0.485 . . . . 73.519999999999996 111.253 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.3 m -61.65 -45.51 93.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.788 0.435 . . . . 72.420000000000002 110.294 175.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.3 mt -61.4 -43.15 99.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.493 0.717 . . . . 44.310000000000002 111.993 -176.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.4 mt -57.77 -40.33 79.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.587 -0.523 . . . . 63.32 109.587 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -82.09 -20.27 38.5 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.646 0.26 . . . . 72.109999999999999 111.26 -172.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.41 18.91 0.14 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.643 2.777 . . . . 75.209999999999994 111.895 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.413 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 89.18 -0.43 81.52 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 125.157 1.36 . . . . 34.100000000000001 114.115 168.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 90.8 mt -77.08 147.93 77.59 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.863 1.332 . . . . 62.210000000000001 111.107 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.32 156.93 60.54 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.152 1.901 . . . . 64.340000000000003 109.441 165.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.47 -42.93 97.24 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 124.127 0.971 . . . . 71.109999999999999 108.909 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.1 -37.15 74.0 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 118.608 -0.71 . . . . 72.209999999999994 111.602 -174.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.1 t -78.58 -47.27 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.446 1.098 . . . . 73.129999999999995 108.287 -179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.16 70.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.173 0.589 . . . . 61.210000000000001 111.578 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.41 -55.35 22.33 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.881 1.273 . . . . 71.209999999999994 110.98 178.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -45.25 83.53 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.022 0.529 . . . . 71.439999999999998 110.101 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.09 -36.08 81.2 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.095 0.558 . . . . 71.549999999999997 111.685 -167.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.61 -45.59 73.68 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.486 1.115 . . . . 74.129999999999995 110.521 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.84 -19.75 65.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 114.26 1.208 . . . . 53.420000000000002 114.26 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.413 HG22 HG22 ' A' ' 30' ' ' VAL . 14.3 mt -72.11 -27.91 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 108.746 -0.835 . . . . 71.319999999999993 108.746 177.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.65 -23.12 24.34 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.649 1.18 . . . . 75.129999999999995 111.656 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.9 t -73.14 -33.56 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 123.624 0.77 . . . . 71.430000000000007 111.262 177.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.44 17.59 15.77 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.509 0.929 . . . . 71.530000000000001 113.509 -164.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.21 33.41 78.17 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 123.781 0.705 . . . . 75.450000000000003 114.343 170.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -94.48 -75.03 0.52 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 127.295 2.238 . . . . 74.239999999999995 108.883 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.413 HG22 HG22 ' A' ' 24' ' ' ILE . 17.6 m -123.32 163.66 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.64 1.176 . . . . 74.530000000000001 110.057 -174.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.86 160.73 25.96 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.901 0.481 . . . . 74.140000000000001 110.492 167.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.67 -28.08 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.566 -0.709 . . . . 61.409999999999997 110.169 166.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.2 p -81.69 -1.05 45.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.098 0.959 . . . . 74.340000000000003 112.272 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.47 -13.24 61.39 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.354 -0.841 . . . . 75.319999999999993 112.95 -171.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.35 156.99 21.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.624 1.169 . . . . 55.350000000000001 111.246 -174.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -91.35 163.21 14.29 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.398 1.079 . . . . 42.310000000000002 108.186 164.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -61.87 -28.35 69.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.764 0.426 . . . . 51.350000000000001 110.589 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -62.63 -29.92 70.98 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.795 -1.191 . . . . 74.109999999999999 111.059 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.87 -47.09 49.07 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.644 -0.693 . . . . 33.32 109.824 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.0 mm -57.22 -38.69 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.587 0.63 . . . . 55.310000000000002 110.224 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.44 -54.44 8.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.101 0.56 . . . . 61.130000000000003 110.573 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.2 64.65 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.26 0.467 . . . . 72.540000000000006 112.26 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 mt -63.11 -42.9 99.66 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.757 1.223 . . . . 74.430000000000007 111.714 171.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -70.52 -24.34 62.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.767 1.167 . . . . 63.149999999999999 110.957 173.593 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -76.84 34.6 0.15 Allowed 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.155 -0.966 . . . . 62.43 111.503 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -134.49 151.93 51.46 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.286 1.034 . . . . 71.129999999999995 108.403 165.263 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -78.86 176.73 9.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.191 0.52 . . . . 64.530000000000001 109.784 161.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -61.3 2.51 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 125.863 1.665 . . . . 73.25 111.32 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -67.07 -24.48 65.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.081 0.552 . . . . 55.030000000000001 111.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.52 -69.64 1.22 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 109.331 -1.508 . . . . 52.43 109.331 170.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.43 -41.27 76.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.26 1.424 . . . . 52.020000000000003 111.503 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.9 mt -62.03 -39.4 92.19 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 118.37 -0.824 . . . . 71.510000000000005 111.501 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.29 84.42 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.572 0.624 . . . . 75.219999999999999 110.012 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 t -55.4 -40.68 58.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.371 0.532 . . . . 73.519999999999996 110.569 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.26 -45.72 69.03 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.623 0.769 . . . . 64.109999999999999 109.794 -176.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -58.49 -51.73 68.64 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.885 0.741 . . . . 73.230000000000004 109.462 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -69.57 -30.68 68.52 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.531 0.605 . . . . 60.109999999999999 111.407 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -67.13 -39.82 86.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.865 1.266 . . . . 74.329999999999998 111.266 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -43.71 78.25 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.493 -0.754 . . . . 60.43 110.083 171.506 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -76.96 46.49 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.497 1.919 . . . . 63.329999999999998 110.212 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.96 -174.77 3.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.923 2.089 . . . . 61.340000000000003 107.686 170.114 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -120.02 112.27 18.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.628 1.171 . . . . 54.340000000000003 108.565 176.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.0 mt -95.59 30.2 2.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.297 1.439 . . . . 71.420000000000002 110.295 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.95 -69.89 0.34 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.933 -1.136 . . . . 65.439999999999998 107.933 163.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -80.19 39.22 0.44 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.27 1.428 . . . . 73.420000000000002 113.083 -173.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -106.91 165.17 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.128 0.971 . . . . 53.520000000000003 108.83 170.176 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.68 -70.52 0.33 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.99 1.316 . . . . 72.150000000000006 108.9 170.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -56.99 75.8 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 128.993 2.917 . . . . 75.439999999999998 111.204 159.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -51.24 -32.04 22.89 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.262 -0.899 . . . . 74.120000000000005 111.644 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.8 p -65.47 -56.84 10.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 118.587 0.63 . . . . 64.549999999999997 109.977 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.67 -33.97 68.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.257 0.623 . . . . 73.109999999999999 111.436 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -60.82 -53.08 61.67 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.299 0.571 . . . . 72.230000000000004 109.945 176.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.1 tp -62.46 -42.45 99.47 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-O 121.445 0.641 . . . . 65.219999999999999 110.025 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.42 -37.75 68.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.79 1.636 . . . . 72.510000000000005 110.379 176.179 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.66 -57.4 17.91 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 124.966 1.27 . . . . 74.420000000000002 110.462 174.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.44 -47.86 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 117.804 0.802 . . . . 40.030000000000001 109.366 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.4 mtt -52.78 -46.74 67.74 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.985 0.914 . . . . 72.239999999999995 112.165 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -57.8 -49.92 75.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 118.796 0.725 . . . . 61.32 109.52 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -43.42 54.7 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.465 0.706 . . . . 62.119999999999997 111.647 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -71.8 -38.12 70.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.166 1.172 . . . . 72.310000000000002 114.166 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -73.66 -21.87 60.14 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.97 1.259 . . . . 74.439999999999998 111.786 172.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 . . . . . 0 N--CA 1.45 -0.442 0 C-N-CA 124.399 1.08 . . . . 61.340000000000003 108.609 -177.461 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 109.801 -1.32 . . . . 72.540000000000006 109.801 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t -129.34 -175.05 3.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.518 1.127 . . . . 70.099999999999994 110.453 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.19 -17.6 64.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 126.649 1.98 . . . . 74.310000000000002 113.924 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -67.95 -36.94 80.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.136 0.88 . . . . 65.200000000000003 109.09 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.53 ' CE2' HD11 ' A' ' 9' ' ' LEU . 54.8 t80 -46.51 -53.35 11.46 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 125.897 1.679 . . . . 62.240000000000002 112.577 -177.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.45 -47.26 86.15 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.769 0.428 . . . . 45.200000000000003 111.552 -175.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.7 m -67.93 -35.59 78.69 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.042 -0.355 . . . . 74.120000000000005 110.042 -176.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.7 -34.96 60.43 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.38 -0.825 . . . . 73.340000000000003 112.067 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.53 HD11 ' CE2' ' A' ' 5' ' ' PHE . 17.3 mt -54.54 -36.23 64.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.32 0.648 . . . . 72.430000000000007 110.063 166.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -83.46 -21.07 32.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.669 0.788 . . . . 74.430000000000007 111.705 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 1.51 6.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.519 1.928 . . . . 71.430000000000007 112.236 174.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.47 0.79 46.9 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.683 1.135 . . . . 51.140000000000001 113.28 174.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.7 mt -84.94 144.72 42.19 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 118.241 1.02 . . . . 73.200000000000003 109.636 -169.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.91 156.04 56.62 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.922 1.748 . . . . 52.0 110.285 173.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -59.32 -45.7 90.59 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 124.951 1.3 . . . . 62.109999999999999 108.698 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -39.59 86.95 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.366 0.416 . . . . 74.329999999999998 111.098 -172.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.72 -58.78 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.681 1.592 . . . . 63.329999999999998 107.994 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.47 -44.99 46.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.448 1.099 . . . . 61.420000000000002 112.532 -174.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -58.6 -41.76 86.58 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.458 1.026 . . . . 44.409999999999997 111.467 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.61 -39.55 64.49 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.809 -0.557 . . . . 74.329999999999998 110.739 177.126 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.9 tp -69.76 -39.64 76.57 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.852 1.261 . . . . 73.319999999999993 110.811 -169.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -53.85 -47.1 71.32 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.952 1.301 . . . . 74.109999999999999 110.819 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.76 -24.78 58.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.77 1.628 . . . . 65.549999999999997 113.468 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -75.07 -25.09 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.128 -0.983 . . . . 72.25 109.183 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -89.43 -10.4 46.58 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.885 1.674 . . . . 70.319999999999993 112.706 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.8 t -84.79 -32.84 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 124.406 1.082 . . . . 65.319999999999993 111.975 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.73 13.86 16.97 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.91 0.777 . . . . 73.340000000000003 112.985 -168.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 61.55 31.44 77.68 Favored Glycine 0 CA--C 1.53 1.004 0 O-C-N 121.617 -0.677 . . . . 54.140000000000001 112.4 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.451 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 22.1 mt -83.54 -65.02 1.06 Allowed 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 126.799 2.04 . . . . 71.129999999999995 108.282 175.11 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.8 m -128.69 156.83 41.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 123.157 0.583 . . . . 71.019999999999996 109.894 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.48 154.65 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.267 0.627 . . . . 50.25 110.192 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.2 p80 -62.42 -15.1 47.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 118.729 -0.653 . . . . 73.25 112.547 175.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.8 p -120.22 22.25 11.45 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.217 1.807 . . . . 74.109999999999999 112.319 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -84.94 -3.49 58.76 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 123.265 1.507 . . . . 73.239999999999995 112.713 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -94.53 -172.86 2.87 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 126.334 1.854 . . . . 71.319999999999993 109.47 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -127.21 175.59 8.04 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.366 0.666 . . . . 74.420000000000002 111.584 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -63.69 -32.69 74.26 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.563 0.745 . . . . 75.230000000000004 111.282 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.1 mtp180 -61.83 -37.29 83.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.497 0.719 . . . . 74.349999999999994 109.947 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.17 93.94 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.651 0.78 . . . . 63.109999999999999 110.867 175.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.62 -50.92 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.954 0.797 . . . . 62.140000000000001 109.965 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -62.11 -51.25 68.67 Favored 'General case' 0 C--O 1.23 0.059 0 N-CA-C 109.875 -0.417 . . . . 71.219999999999999 109.875 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.47 69.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.164 -0.922 . . . . 74.409999999999997 112.299 -176.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.07 -51.73 67.91 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.955 0.798 . . . . 74.549999999999997 110.661 169.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.11 -39.99 83.97 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.003 0.82 . . . . 72.409999999999997 111.487 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -77.12 38.45 0.22 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-N 119.285 0.948 . . . . 74.540000000000006 112.473 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -129.1 146.75 50.97 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.335 -1.357 . . . . 72.329999999999998 107.335 161.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -68.49 170.3 9.31 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.826 0.346 . . . . 74.140000000000001 110.483 163.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -47.53 -64.17 0.86 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 127.38 2.272 . . . . 64.549999999999997 110.786 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -31.12 71.84 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 123.365 0.666 . . . . 73.430000000000007 110.871 -172.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.84 -53.95 10.56 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 110.319 -1.112 . . . . 62.240000000000002 110.319 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.5 -37.63 75.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.8 1.24 . . . . 70.239999999999995 111.599 177.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.98 -43.32 95.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 119.447 1.021 . . . . 65.530000000000001 110.937 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.512 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -61.74 -45.07 95.53 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.992 0.901 . . . . 61.140000000000001 110.785 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.23 -37.5 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.939 0.896 . . . . 50.420000000000002 110.315 176.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.03 -48.6 20.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 119.057 0.844 . . . . 70.140000000000001 110.994 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -57.5 -41.74 81.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.592 -0.892 . . . . 72.340000000000003 108.592 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -82.65 -10.07 59.1 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 112.866 0.691 . . . . 74.349999999999994 112.866 -176.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -67.18 -61.03 2.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.805 -0.813 . . . . 74.519999999999996 108.805 166.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -65.74 -39.73 91.39 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 118.697 -0.668 . . . . 70.439999999999998 110.453 -178.9 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -82.73 54.63 2.74 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.289 1.436 . . . . 63.140000000000001 110.145 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.97 -172.75 4.13 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.853 2.061 . . . . 74.239999999999995 107.999 173.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -129.51 114.69 16.42 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.212 1.405 . . . . 73.120000000000005 108.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.97 24.39 7.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.651 2.38 . . . . 70.319999999999993 110.8 -176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.6 t -70.5 -22.64 62.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.05 1.34 . . . . 33.509999999999998 112.512 -177.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -125.41 12.6 8.14 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.509 1.123 . . . . 63.520000000000003 112.301 -171.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.2 p -90.84 140.42 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.883 0.765 . . . . 70.430000000000007 109.314 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -36.2 23.09 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 122.287 -0.258 . . . . 62.219999999999999 111.183 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -137.9 118.56 14.01 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.424 1.49 . . . . 72.239999999999995 107.303 -163.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -64.4 -39.14 93.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.171 0.804 . . . . 70.510000000000005 113.171 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -40.33 94.41 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 124.884 1.274 . . . . 72.140000000000001 107.677 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.16 -19.3 65.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.857 0.753 . . . . 42.140000000000001 112.61 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -79.3 -51.24 9.7 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 122.15 0.976 . . . . 73.439999999999998 108.591 173.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.73 -47.27 86.31 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.203 -1.362 . . . . 71.329999999999998 108.408 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.6 p -59.91 -26.69 66.12 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.768 1.627 . . . . 63.350000000000001 110.411 -176.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.2 -53.05 5.36 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.154 -0.779 . . . . 74.349999999999994 111.154 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.9 t -57.23 -40.58 74.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 117.375 0.587 . . . . 71.239999999999995 110.031 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.0 mtt -55.48 -45.08 77.01 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 121.358 -0.839 . . . . 62.310000000000002 111.073 175.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -63.5 -54.75 31.43 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 108.908 -0.775 . . . . 74.219999999999999 108.908 -171.818 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.3 t -63.83 -36.81 85.13 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.889 -0.577 . . . . 45.049999999999997 110.543 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.512 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 2.4 m-85 -58.26 -44.73 88.52 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 120.14 1.336 . . . . 74.329999999999998 113.36 174.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.04 -11.51 59.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.253 0.479 . . . . 64.549999999999997 111.487 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 . . . . . 0 C--O 1.236 0.369 0 C-N-CA 125.244 1.418 . . . . 65.340000000000003 109.155 177.152 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.396 0 N-CA-C 111.442 -0.663 . . . . 65.510000000000005 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.43 -172.83 3.0 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.921 1.688 . . . . 73.25 110.579 -177.647 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -45.15 -44.15 10.47 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.483 2.313 . . . . 71.510000000000005 110.343 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.76 -39.14 80.11 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.461 1.104 . . . . 74.519999999999996 110.317 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -53.12 -57.96 8.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.269 1.027 . . . . 71.450000000000003 111.204 -175.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -65.04 -39.05 92.77 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.25 -0.58 . . . . 72.450000000000003 110.554 -175.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.6 m -65.8 -36.79 84.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.168 0.44 . . . . 64.230000000000004 110.122 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.13 -37.18 86.2 Favored 'General case' 0 C--N 1.34 0.179 0 O-C-N 120.816 -1.177 . . . . 70.450000000000003 111.105 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.2 mm? -65.52 -18.58 65.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 119.13 -0.462 . . . . 72.420000000000002 111.79 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.74 -14.16 21.0 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.778 0.831 . . . . 65.040000000000006 111.511 173.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.23 -0.34 14.1 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.033 1.733 . . . . 70.25 112.382 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.29 14.91 24.82 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.716 -1.047 . . . . 62.229999999999997 113.304 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.8 mt -113.12 152.44 45.03 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 118.927 1.364 . . . . 74.420000000000002 111.815 -166.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.3 160.41 48.89 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.005 2.47 . . . . 71.140000000000001 110.911 172.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.509 ' HA ' HD11 ' A' ' 9' ' ' LEU . 14.7 tt0 -64.43 -46.0 85.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.252 -1.018 . . . . 64.519999999999996 108.252 178.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.79 -38.11 74.92 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.568 0.951 . . . . 71.329999999999998 113.568 -170.779 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.7 t -78.63 -43.05 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.605 -1.257 . . . . 53.119999999999997 107.605 178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.3 -32.32 56.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.968 0.804 . . . . 22.199999999999999 111.927 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.02 -23.25 65.27 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 114.367 1.247 . . . . 64.329999999999998 114.367 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.84 -6.14 20.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 118.947 0.794 . . . . 73.120000000000005 111.92 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 25' ' ' TYR . 1.2 tt -104.66 -27.96 11.51 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 124.762 1.225 . . . . 74.549999999999997 111.59 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.04 -41.86 88.86 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.314 0.961 . . . . 53.229999999999997 111.484 173.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.96 -24.24 51.61 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.232 1.413 . . . . 73.450000000000003 114.002 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.423 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.0 mt -73.25 -18.12 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.801 0.841 . . . . 73.25 109.436 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.592 ' HE2' HD23 ' A' ' 21' ' ' LEU . 65.3 m-85 -99.79 -27.77 13.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.445 1.498 . . . . 74.109999999999999 112.651 175.033 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.3 t -58.87 -51.06 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-O 118.996 -0.526 . . . . 71.450000000000003 110.496 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.08 0.88 46.61 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.93 1.085 . . . . 62.420000000000002 113.93 -162.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 44.34 87.96 Favored Glycine 0 CA--C 1.529 0.92 0 O-C-N 121.245 -0.909 . . . . 64.239999999999995 112.016 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.4 mt -82.09 -74.59 0.34 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 126.552 1.941 . . . . 74.239999999999995 107.035 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 m -103.34 146.84 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 N-CA-C 113.83 1.048 . . . . 44.109999999999999 113.83 172.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.17 26.89 0.06 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 129.003 2.921 . . . . 72.340000000000003 116.46 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . 0.303 2.9 p80 55.46 -21.24 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.828 2.851 . . . . 63.020000000000003 116.75 -165.815 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.1 p -129.14 16.55 6.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.447 1.476 . . . . 70.049999999999997 112.118 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.73 -15.41 58.46 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.299 1.44 . . . . 70.120000000000005 113.709 -173.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.14 170.41 10.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.619 1.568 . . . . 74.049999999999997 111.601 -160.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -105.45 158.51 16.61 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.831 -0.803 . . . . 64.010000000000005 108.831 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -47.59 -46.86 28.67 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.769 2.028 . . . . 52.240000000000002 110.45 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -59.16 -35.19 73.09 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 122.987 0.515 . . . . 72.409999999999997 111.973 -176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.88 62.38 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.442 -0.79 . . . . 73.019999999999996 110.291 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 6.9 mm -71.79 -41.12 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 74.150000000000006 110.135 175.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.64 -58.59 6.46 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.867 -0.79 . . . . 73.099999999999994 108.867 175.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.85 -40.2 63.19 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.245 1.018 . . . . 70.319999999999993 111.471 -174.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.2 mt -46.99 -54.09 10.94 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 124.424 1.09 . . . . 62.409999999999997 111.541 173.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -28.6 69.22 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.462 0.574 . . . . 72.219999999999999 111.773 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -73.25 -16.22 61.4 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.479 -0.763 . . . . 65.030000000000001 112.441 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -85.93 137.44 32.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.567 1.147 . . . . 74.530000000000001 110.937 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.36 166.01 3.28 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 113.341 -1.754 . . . . 72.319999999999993 110.677 156.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.14 -58.16 9.12 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 113.946 -1.479 . . . . 72.219999999999999 110.553 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.03 -30.95 70.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.874 0.369 . . . . 75.519999999999996 111.406 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.26 -66.98 2.44 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 108.564 -1.814 . . . . 54.039999999999999 108.564 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.5 -42.0 70.26 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.986 0.735 . . . . 51.200000000000003 112.986 -177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.14 -41.61 88.72 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.763 0.825 . . . . 72.540000000000006 111.405 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.432 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -73.1 -42.51 62.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.361 0.264 . . . . 42.399999999999999 110.812 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 70.0 t -54.28 -29.85 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.442 1.497 . . . . 71.209999999999994 110.27 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.561 HD21 HD12 ' A' ' 21' ' ' LEU . 13.7 mt -77.48 -54.52 6.32 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.36 1.064 . . . . 74.310000000000002 109.013 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -56.76 -51.09 70.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 123.634 0.584 . . . . 71.439999999999998 109.869 -175.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -72.29 -7.5 49.8 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.267 0.84 . . . . 70.420000000000002 113.267 -172.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -93.64 -58.41 2.28 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 125.833 1.653 . . . . 72.219999999999999 110.216 174.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -58.05 -33.37 68.93 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.591 1.156 . . . . 70.129999999999995 110.885 178.159 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -76.77 52.33 0.83 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.247 1.819 . . . . 61.549999999999997 109.977 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m -154.73 171.56 19.35 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 120.23 -1.544 . . . . 71.109999999999999 109.814 168.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -110.68 96.98 6.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.084 1.354 . . . . 64.450000000000003 107.673 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.5 mt -89.65 -6.25 56.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 118.1 -0.952 . . . . 72.230000000000004 112.782 -164.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.84 -56.06 5.85 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 73.310000000000002 111.722 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -101.2 9.93 41.35 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.42 0.688 . . . . 72.209999999999994 112.415 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.6 t -73.5 104.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 106.803 -1.555 . . . . 72.430000000000007 106.803 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -62.67 -28.04 69.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.326 1.05 . . . . 72.409999999999997 113.251 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -129.15 96.15 4.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.996 0.918 . . . . 73.120000000000005 108.639 177.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -54.27 -33.83 59.48 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.218 1.007 . . . . 73.019999999999996 109.999 172.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 m -69.66 -51.04 38.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.789 1.635 . . . . 74.25 111.39 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.18 74.45 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.15 0.432 . . . . 74.219999999999999 110.393 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -64.73 -51.8 60.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.02 -0.733 . . . . 72.230000000000004 109.02 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.3 tp -67.62 -58.09 5.3 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.628 1.171 . . . . 73.420000000000002 110.205 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -22.54 66.94 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.601 -0.727 . . . . 74.120000000000005 110.983 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.42 -48.44 14.03 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.193 -0.782 . . . . 25.0 111.35 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.0 t -55.31 -45.19 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 118.453 1.126 . . . . 74.109999999999999 109.678 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.1 mtt -50.78 -51.41 50.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.471 0.578 . . . . 64.230000000000004 111.147 171.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -49.09 73.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.826 -0.607 . . . . 73.230000000000004 110.357 -174.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -46.47 89.46 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.379 0.536 . . . . 42.119999999999997 110.8 175.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.432 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 1.5 m-85 -54.28 -52.63 60.82 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.76 0.709 . . . . 73.129999999999995 111.84 -175.234 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -67.92 -9.33 44.26 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.132 0.573 . . . . 71.140000000000001 111.493 -177.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 . . . . . 0 N--CA 1.45 -0.427 0 C-N-CA 126.379 1.872 . . . . 73.099999999999994 110.573 -179.261 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.484 0 N-CA-C 109.563 -1.415 . . . . 43.439999999999998 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 t -101.83 -178.39 3.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.461 0.648 . . . . 71.129999999999995 110.734 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.91 -24.35 66.9 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.175 -0.466 . . . . 64.430000000000007 111.499 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.44 -40.84 83.66 Favored 'General case' 0 C--N 1.346 0.423 0 N-CA-C 109.022 -0.733 . . . . 71.150000000000006 109.022 -176.333 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -45.16 -53.44 8.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.853 1.261 . . . . 73.420000000000002 112.545 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -65.47 -41.6 93.16 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.224 -0.417 . . . . 72.430000000000007 111.602 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -65.66 -31.43 72.44 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.475 0.71 . . . . 71.319999999999993 110.769 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.53 -40.55 76.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.884 -1.135 . . . . 70.120000000000005 110.268 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 15' ' ' GLN . 1.1 mm? -62.14 -23.47 66.59 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.984 0.811 . . . . 62.340000000000003 111.579 176.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.82 -18.87 38.95 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.508 0.594 . . . . 53.020000000000003 111.647 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.38 -0.46 29.16 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.972 -1.08 . . . . 51.32 112.754 -161.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 7.09 45.67 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.429 1.014 . . . . 54.420000000000002 111.964 -171.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.0 144.92 28.66 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 118.504 1.152 . . . . 74.129999999999995 110.04 -172.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.72 163.21 38.02 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.117 1.878 . . . . 61.399999999999999 110.228 167.648 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.421 ' HA ' HD11 ' A' ' 9' ' ' LEU . 27.1 tt0 -57.7 -48.12 80.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.312 -0.996 . . . . 73.439999999999998 108.312 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HD3' HD11 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -60.46 -31.45 70.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 112.896 0.702 . . . . 75.209999999999994 112.896 -169.269 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.15 -51.5 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.288 1.435 . . . . 71.5 108.591 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -38.65 71.84 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.427 0.691 . . . . 73.530000000000001 111.98 -177.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.0 -48.1 52.64 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.804 1.642 . . . . 75.310000000000002 110.966 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.29 31.58 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 124.563 1.145 . . . . 72.540000000000006 110.465 -175.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.47 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -66.37 -42.83 87.44 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 119.419 1.008 . . . . 62.100000000000001 111.376 177.73 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -51.02 -41.52 59.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.337 1.055 . . . . 64.519999999999996 111.328 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -53.29 -36.62 61.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 127.594 2.358 . . . . 75.200000000000003 112.712 177.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.4 mt -74.5 -14.07 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.093 0.957 . . . . 63.539999999999999 108.64 -174.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.47 ' CE2' HD23 ' A' ' 21' ' ' LEU . 45.2 m-85 -100.58 -8.95 22.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.792 1.637 . . . . 72.5 112.086 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 84.5 t -78.55 -34.5 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 125.496 1.518 . . . . 74.239999999999995 111.265 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 -3.89 58.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.235 1.198 . . . . 51.240000000000002 114.235 -161.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 63.97 28.9 73.45 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 121.363 -0.836 . . . . 74.439999999999998 111.46 -163.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 mt -71.36 -81.94 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 128.253 2.621 . . . . 74.510000000000005 105.783 162.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.0 m -124.71 176.79 5.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 123.724 0.81 . . . . 71.120000000000005 111.48 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.37 155.25 20.21 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 125.184 1.393 . . . . 74.340000000000003 108.044 166.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -48.77 -32.32 8.41 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.605 1.562 . . . . 71.329999999999998 112.343 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.07 5.88 31.55 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.998 2.119 . . . . 71.099999999999994 113.47 -175.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.82 -15.21 63.44 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 119.276 -2.14 . . . . 72.5 114.522 -177.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.6 mt -95.89 136.94 35.66 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.753 0.821 . . . . 73.420000000000002 111.729 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.79 155.33 40.92 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.136 -1.431 . . . . 73.420000000000002 107.136 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.12 -32.6 71.16 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.787 -0.57 . . . . 71.540000000000006 110.961 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -61.89 -29.63 70.33 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.684 0.794 . . . . 73.140000000000001 112.773 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.97 -35.87 31.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.644 -0.502 . . . . 73.340000000000003 109.644 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mm -60.86 -43.26 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.657 0.662 . . . . 70.409999999999997 109.28 172.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.24 -55.85 24.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.431 1.092 . . . . 70.109999999999999 110.244 171.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.97 -37.76 74.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 119.224 -0.417 . . . . 54.030000000000001 111.743 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -42.28 78.81 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.479 0.712 . . . . 74.239999999999995 111.596 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -25.89 67.08 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.627 0.648 . . . . 74.510000000000005 112.585 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -75.87 -13.28 60.27 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 120.007 1.276 . . . . 64.209999999999994 113.118 -173.318 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -90.69 135.53 33.65 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.514 1.526 . . . . 54.100000000000001 108.714 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -65.97 170.01 6.06 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.278 -0.873 . . . . 54.140000000000001 110.595 163.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -46.78 -64.39 0.78 Allowed 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 126.997 2.119 . . . . 73.420000000000002 111.52 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -64.15 -36.69 84.85 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.009 0.524 . . . . 74.230000000000004 111.817 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -64.87 -46.36 89.72 Favored Glycine 0 C--N 1.34 0.797 0 N-CA-C 110.617 -0.993 . . . . 54.32 110.617 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.56 82.01 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.932 1.693 . . . . 73.510000000000005 110.395 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.527 HD11 ' HD3' ' A' ' 16' ' ' LYS . 48.0 mt -55.19 -45.63 75.81 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.713 0.688 . . . . 74.5 110.362 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.15 82.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.74 0.274 . . . . 72.219999999999999 111.74 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 77' ' ' MET . 41.9 t -56.64 -41.94 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.29 1.036 . . . . 74.5 110.564 175.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.15 -43.29 78.61 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.668 -0.645 . . . . 74.409999999999997 110.213 -174.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -62.93 -39.81 95.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.384 -0.969 . . . . 71.230000000000004 108.384 -176.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -74.19 -31.14 62.54 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 118.273 0.488 . . . . 75.400000000000006 111.231 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.71 -57.99 10.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.916 0.486 . . . . 73.409999999999997 109.892 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -21.97 66.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.336 -0.84 . . . . 74.430000000000007 112.105 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -74.99 49.01 0.41 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.42 1.009 . . . . 62.439999999999998 109.564 164.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.7 m -152.52 150.05 29.17 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.362 1.465 . . . . 52.310000000000002 111.566 172.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -97.58 87.21 4.02 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 122.946 1.355 . . . . 71.299999999999997 109.617 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 mt -76.76 46.33 0.45 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.619 1.968 . . . . 43.399999999999999 111.378 -172.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.8 m -95.04 -5.46 44.38 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.526 1.531 . . . . 64.530000000000001 112.607 167.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -125.72 41.2 3.57 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.498 -1.376 . . . . 70.109999999999999 111.463 -175.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.69 100.58 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 124.899 1.279 . . . . 74.329999999999998 109.959 -168.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.4 ' H ' ' CD ' ' A' ' 67' ' ' GLN . 0.1 OUTLIER -65.69 -47.07 76.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.32 1.048 . . . . 74.129999999999995 112.599 176.497 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -107.43 99.03 8.57 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 106.589 -1.634 . . . . 65.439999999999998 106.589 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -60.35 -34.72 74.24 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.079 0.466 . . . . 74.420000000000002 109.964 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 72.5 p -64.71 -55.53 19.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.634 1.174 . . . . 61.329999999999998 110.659 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.88 -26.73 67.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 119.081 -0.485 . . . . 73.239999999999995 112.028 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -63.31 -54.34 38.55 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.696 0.68 . . . . 72.230000000000004 109.866 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.72 -52.88 63.8 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.967 0.907 . . . . 74.400000000000006 109.613 -178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.11 -29.29 65.38 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 115.749 -0.66 . . . . 54.32 112.194 176.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.61 -39.15 90.71 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.708 1.147 . . . . 64.400000000000006 112.263 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 94.9 t -64.67 -48.52 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 107.67 -1.233 . . . . 74.430000000000007 107.67 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.402 ' HG3' HG11 ' A' ' 54' ' ' VAL . 6.0 mtp -58.52 -33.14 69.52 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.011 -1.056 . . . . 71.400000000000006 112.297 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -58.05 -58.15 9.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.84 -0.8 . . . . 70.400000000000006 108.84 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.9 t -62.49 -50.1 72.73 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.934 -0.555 . . . . 74.120000000000005 110.157 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -49.14 -28.66 4.51 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 117.475 2.398 . . . . 65.239999999999995 117.475 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -115.28 0.24 13.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.337 0.971 . . . . 63.5 112.659 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 126.738 2.015 . . . . 72.319999999999993 108.799 159.456 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.775 0 N-CA-C 110.569 -1.013 . . . . 62.149999999999999 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -127.16 -165.37 1.46 Allowed 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.985 0.914 . . . . 74.530000000000001 110.755 -173.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -55.07 -28.95 56.26 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 113.921 1.082 . . . . 73.549999999999997 113.921 -166.847 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -34.65 78.54 Favored 'General case' 0 N--CA 1.461 0.103 0 C-N-CA 123.525 0.73 . . . . 71.430000000000007 110.447 -177.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -54.79 -47.53 73.85 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.491 1.116 . . . . 74.319999999999993 110.348 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -62.26 -49.48 75.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.947 -0.549 . . . . 71.530000000000001 110.378 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -55.08 -49.55 71.4 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.425 1.09 . . . . 70.450000000000003 109.703 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.4 mt -65.8 -39.2 90.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 O-C-N 121.67 -0.644 . . . . 72.150000000000006 111.257 -177.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -64.13 -15.13 59.09 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 118.768 -0.634 . . . . 72.430000000000007 111.522 175.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.77 2.35 27.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.895 1.678 . . . . 74.230000000000004 112.711 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -96.95 24.3 6.35 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.039 1.336 . . . . 71.340000000000003 111.861 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.95 16.9 78.29 Favored Glycine 0 CA--C 1.525 0.692 0 O-C-N 121.18 -0.95 . . . . 62.149999999999999 112.979 -177.57 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -111.02 156.82 40.26 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 118.65 1.225 . . . . 72.510000000000005 111.371 -173.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.82 173.92 13.69 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.259 3.306 . . . . 63.439999999999998 113.917 175.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -76.68 -46.01 27.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 126.377 1.871 . . . . 73.549999999999997 111.055 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -57.37 -42.08 81.41 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 118.948 0.794 . . . . 65.25 111.34 -176.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.3 t -58.49 -63.28 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 125.017 1.327 . . . . 72.109999999999999 108.107 168.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.21 -47.27 24.44 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.161 1.385 . . . . 71.530000000000001 112.012 -171.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -53.01 -56.9 12.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.624 1.569 . . . . 71.030000000000001 110.828 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -67.4 -38.65 85.01 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.907 -0.405 . . . . 50.43 109.907 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.22 -42.65 65.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.206 1.402 . . . . 70.540000000000006 110.976 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -49.82 -50.52 44.83 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.017 1.727 . . . . 73.549999999999997 110.461 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.17 -16.3 52.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.947 1.699 . . . . 73.25 113.617 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.2 mt -73.75 -31.38 31.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 120.994 -1.066 . . . . 64.5 108.707 175.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -85.39 -48.38 9.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.882 0.873 . . . . 74.549999999999997 110.228 -177.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -53.83 -39.53 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.58 0.752 . . . . 73.230000000000004 111.758 -175.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.75 0.31 7.35 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.129 0.971 . . . . 73.219999999999999 112.888 -175.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.83 7.01 71.63 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 125.327 1.442 . . . . 63.299999999999997 112.793 174.3 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 59' ' ' LYS . 39.8 mt -75.91 -59.8 2.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.13 0.965 . . . . 74.129999999999995 109.704 -166.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.7 167.25 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.24 1.016 . . . . 70.219999999999999 112.248 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.2 155.26 27.47 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.774 0.829 . . . . 71.200000000000003 109.779 171.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -73.8 -38.18 64.7 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.949 -0.469 . . . . 72.310000000000002 110.661 175.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.33 7.72 9.0 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.72 0.691 . . . . 72.219999999999999 112.395 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.02 -4.36 40.84 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.991 1.108 . . . . 73.129999999999995 113.991 -166.256 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.492 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -107.46 169.44 8.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.727 1.211 . . . . 73.409999999999997 110.325 -175.832 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -108.36 172.11 7.02 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.27 1.428 . . . . 74.340000000000003 109.836 -173.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.1 -44.64 64.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.037 1.335 . . . . 74.409999999999997 111.344 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -57.56 -22.84 47.12 Favored 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 125.795 1.638 . . . . 73.400000000000006 113.673 175.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.2 -36.38 34.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.939 -1.029 . . . . 74.329999999999998 110.283 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.8 mm -63.41 -59.75 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 108.218 -1.031 . . . . 74.140000000000001 108.218 172.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -58.98 -47.55 84.75 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.231 1.012 . . . . 70.200000000000003 111.189 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -30.14 66.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 118.012 -0.994 . . . . 71.439999999999998 111.712 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.3 -38.35 65.82 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-N 119.728 1.149 . . . . 65.5 111.204 170.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -64.01 -26.42 68.56 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.777 0.717 . . . . 74.209999999999994 111.525 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -74.88 -18.04 60.49 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.685 -0.634 . . . . 74.430000000000007 112.051 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -88.52 140.5 29.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.203 1.001 . . . . 71.340000000000003 109.521 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -69.23 176.22 3.42 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.27 -1.332 . . . . 70.140000000000001 109.367 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -54.76 -59.28 4.93 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.22 -1.354 . . . . 74.25 111.673 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.56 -27.89 45.91 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 119.64 -0.219 . . . . 51.520000000000003 110.972 -170.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.17 -48.96 79.29 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.424 -1.47 . . . . 65.239999999999995 109.424 171.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.84 -43.99 94.33 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.807 0.803 . . . . 72.129999999999995 110.576 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.91 -36.29 83.47 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.5 -0.75 . . . . 54.340000000000003 112.012 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -43.85 82.56 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.029 0.831 . . . . 72.099999999999994 110.517 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 65.5 t -55.07 -42.09 62.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 123.255 0.622 . . . . 64.510000000000005 109.729 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.42 -38.06 56.14 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 121.77 -0.581 . . . . 61.409999999999997 111.653 -175.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.45 -28.85 68.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.727 -0.654 . . . . 62.32 110.617 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -75.42 -36.28 60.82 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.925 0.784 . . . . 73.430000000000007 110.48 171.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -56.48 -57.74 11.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.976 0.91 . . . . 72.299999999999997 111.63 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HE2' HD12 ' A' ' 29' ' ' LEU . 34.0 ttmt -63.54 -30.15 71.31 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.548 0.613 . . . . 71.439999999999998 111.46 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -73.83 10.23 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.323 1.449 . . . . 74.030000000000001 113.117 -172.492 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.2 m -112.57 165.98 11.75 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.486 1.514 . . . . 61.32 111.666 -173.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -95.99 105.54 17.59 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 107.713 -1.218 . . . . 71.329999999999998 107.713 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.541 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 91.8 mt -92.22 -7.28 48.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.698 -0.683 . . . . 72.140000000000001 112.823 -171.451 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 m -60.29 -27.01 66.95 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.433 1.642 . . . . 61.340000000000003 115.433 -169.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -131.72 16.11 4.82 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.344 1.057 . . . . 62.219999999999999 111.439 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -64.04 154.28 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.573 1.149 . . . . 51.009999999999998 109.966 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -63.64 1.24 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.374 -0.376 . . . . 74.400000000000006 110.355 -178.291 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -127.1 134.76 50.18 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 106.638 -1.616 . . . . 52.399999999999999 106.638 166.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.541 ' HE3' ' HB3' ' A' ' 63' ' ' LEU . 29.8 mmtm -59.57 -27.4 66.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.084 0.865 . . . . 61.219999999999999 111.051 172.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.7 p -72.66 -53.08 12.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.473 0.709 . . . . 70.439999999999998 110.398 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.96 -38.91 65.47 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.8 0.44 . . . . 64.200000000000003 111.425 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -60.05 -51.78 68.17 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.732 0.777 . . . . 65.409999999999997 109.531 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.9 tp -62.17 -52.07 65.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.705 -0.85 . . . . 73.319999999999993 108.705 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 11.9 t -57.65 -28.22 63.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.03 0.932 . . . . 62.240000000000002 111.448 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.43 -49.6 50.21 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 111.16 -0.776 . . . . 30.120000000000001 111.16 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.94 -37.85 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 117.826 0.813 . . . . 74.129999999999995 111.254 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.2 mtt -55.21 -44.83 75.76 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.0 -1.063 . . . . 64.200000000000003 111.09 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -58.5 -50.68 72.86 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.01 0.924 . . . . 73.409999999999997 110.723 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 t -68.63 -36.35 78.51 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.605 -1.188 . . . . 63.539999999999999 111.112 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -65.23 -31.11 72.1 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 122.245 2.293 . . . . 63.200000000000003 112.798 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 mmm-85 -69.52 -28.19 65.82 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 121.173 -0.954 . . . . 73.5 111.279 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 . . . . . 0 C--O 1.241 0.65 0 C-N-CA 125.857 1.663 . . . . 63.43 110.471 -176.846 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.552 0 N-CA-C 110.564 -1.014 . . . . 55.549999999999997 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.55 -179.97 7.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.675 1.226 . . . . 75.219999999999999 110.476 174.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -28.97 67.13 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 114.733 -1.121 . . . . 74.030000000000001 112.219 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -52.71 -31.35 37.22 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.865 1.266 . . . . 60.350000000000001 112.86 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.4 -42.82 74.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.264 0.626 . . . . 74.25 110.948 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -64.27 -46.44 83.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.279 1.031 . . . . 73.209999999999994 111.999 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -70.24 -30.36 67.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.022 0.828 . . . . 70.25 110.365 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.58 -47.87 79.73 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 120.86 -1.15 . . . . 63.219999999999999 109.505 172.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 15' ' ' GLN . 29.0 mt -65.25 -15.04 62.06 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.928 0.891 . . . . 61.109999999999999 113.175 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -87.88 -42.14 12.72 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.501 1.92 . . . . 44.149999999999999 110.431 174.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.16 15.81 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.684 2.794 . . . . 74.140000000000001 112.902 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.35 12.33 84.66 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 127.174 2.321 . . . . 54.210000000000001 112.641 175.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.8 mt -85.71 145.98 42.84 Favored Pre-proline 0 C--O 1.237 0.417 0 CA-C-N 118.424 1.112 . . . . 41.409999999999997 108.908 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -71.02 167.75 25.18 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.578 2.186 . . . . 53.450000000000003 112.478 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.504 ' HA ' HD21 ' A' ' 9' ' ' LEU . 46.6 tt0 -70.84 -48.07 55.93 Favored 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 124.974 1.309 . . . . 70.329999999999998 110.053 -174.05 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -62.45 -40.15 95.67 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 119.457 -0.897 . . . . 50.409999999999997 111.107 -172.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 76.6 t -60.53 -57.07 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.178 -1.045 . . . . 72.150000000000006 108.178 172.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.72 -42.1 62.02 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.411 1.085 . . . . 61.030000000000001 113.55 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.12 -52.34 64.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.96 0.904 . . . . 73.510000000000005 110.566 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -28.58 62.34 Favored 'General case' 0 N--CA 1.461 0.085 0 O-C-N 121.694 -0.629 . . . . 74.239999999999995 110.144 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.541 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -68.23 -35.24 77.65 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.731 0.696 . . . . 74.230000000000004 111.28 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -53.03 -43.43 66.57 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.731 1.213 . . . . 64.450000000000003 111.57 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -64.57 -15.34 60.89 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 125.633 1.573 . . . . 72.549999999999997 113.883 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -76.5 -42.52 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.921 -1.14 . . . . 71.420000000000002 107.921 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.541 ' CE2' HD23 ' A' ' 21' ' ' LEU . 53.2 m-85 -84.39 -10.47 57.53 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 113.586 0.958 . . . . 74.319999999999993 113.586 -172.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.4 t -86.59 -19.92 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 119.081 0.855 . . . . 72.340000000000003 110.576 170.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.64 7.26 30.71 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.272 -0.893 . . . . 61.409999999999997 113.371 -165.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.19 5.55 48.95 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.31 -0.869 . . . . 54.340000000000003 113.848 -175.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -77.1 -61.08 2.1 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.805 1.302 . . . . 62.210000000000001 109.15 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.14 -174.25 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 123.664 0.785 . . . . 63.130000000000003 110.634 176.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -124.65 154.96 39.96 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.499 2.32 . . . . 73.409999999999997 107.585 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -57.91 -19.47 30.04 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.699 1.0 . . . . 72.349999999999994 113.699 -174.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -104.41 15.35 28.38 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.832 -1.167 . . . . 64.430000000000007 111.871 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -67.41 -18.48 65.13 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.92 -1.737 . . . . 71.219999999999999 114.228 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 70' ' ' SER . 85.2 mt -90.58 167.81 12.27 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.703 0.801 . . . . 75.319999999999993 111.59 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.97 156.84 17.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.629 -1.619 . . . . 55.450000000000003 106.629 171.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -64.35 -30.02 71.08 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.564 -0.71 . . . . 70.439999999999998 110.27 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -55.12 -22.48 16.83 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.446 1.098 . . . . 64.25 113.611 170.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -92.94 -44.52 8.4 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.004 1.322 . . . . 73.349999999999994 110.925 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.25 -42.53 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 119.146 0.885 . . . . 43.109999999999999 109.36 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -51.09 -49.3 60.96 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.498 1.119 . . . . 74.219999999999999 111.135 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.8 92.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.903 0.481 . . . . 63.020000000000003 110.092 -172.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 mt -58.44 -34.19 70.55 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.598 0.592 . . . . 73.120000000000005 112.598 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -60.54 -26.99 67.3 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 119.126 -0.464 . . . . 71.310000000000002 111.54 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -80.13 -18.19 50.5 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.81 1.041 . . . . 72.209999999999994 113.81 -168.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -87.12 155.41 20.13 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.008 1.323 . . . . 72.349999999999994 110.006 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -79.56 -177.66 5.93 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.273 1.429 . . . . 74.109999999999999 110.397 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -52.14 -70.86 0.08 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.109 1.764 . . . . 73.540000000000006 110.492 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -60.92 -45.59 94.05 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 124.886 1.275 . . . . 75.450000000000003 109.994 -174.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.564 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -55.78 -54.7 33.22 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 110.207 -1.157 . . . . 52.009999999999998 110.207 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.57 76.32 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.882 0.841 . . . . 65.450000000000003 110.672 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.61 -41.54 66.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.207 1.003 . . . . 75.409999999999997 110.815 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.98 79.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.882 0.31 . . . . 74.129999999999995 110.505 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 50' ' ' GLY . 11.0 t -58.97 -34.99 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 124.474 1.109 . . . . 74.540000000000006 110.471 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.9 -43.24 83.91 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.498 0.719 . . . . 75.209999999999994 109.985 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -43.97 92.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.122 -1.436 . . . . 72.230000000000004 107.122 -177.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -76.3 -33.71 59.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.488 -0.56 . . . . 62.409999999999997 109.488 -168.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -60.15 -62.7 1.68 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.471 1.108 . . . . 72.349999999999994 110.785 171.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -44.54 62.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.967 1.707 . . . . 74.430000000000007 111.701 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.22 15.05 0.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.852 1.261 . . . . 74.209999999999994 113.47 -173.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.7 m -112.53 173.68 6.26 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.478 1.511 . . . . 52.030000000000001 111.383 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -103.41 123.94 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.498 -1.667 . . . . 63.509999999999998 106.498 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.8 mt -105.68 -9.55 17.26 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 125.256 1.423 . . . . 74.209999999999994 112.242 -171.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.5 m -56.68 -26.81 57.43 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.717 2.007 . . . . 75.319999999999993 114.637 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -122.91 11.57 9.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.573 1.149 . . . . 72.420000000000002 110.924 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.7 t -71.38 127.83 33.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 O-C-N 120.891 -1.13 . . . . 75.329999999999998 108.205 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -64.29 -56.73 12.51 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.136 1.775 . . . . 52.43 110.379 -175.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -128.77 126.01 39.05 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 105.291 -2.114 . . . . 75.329999999999998 105.291 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -60.96 -27.78 68.5 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.558 0.536 . . . . 73.430000000000007 111.629 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . 0.402 ' HB3' ' HA ' ' A' ' 35' ' ' LEU . 12.4 p -73.77 -54.05 8.92 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.127 2.171 . . . . 73.430000000000007 110.81 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.01 64.69 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 118.356 0.525 . . . . 71.319999999999993 111.984 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -67.21 -46.5 73.68 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 120.603 0.24 . . . . 61.219999999999999 110.535 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -62.54 -42.88 99.81 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.811 0.444 . . . . 73.349999999999994 110.171 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.64 -28.4 63.67 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.14 -0.933 . . . . 72.519999999999996 112.557 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.6 -55.98 6.33 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.356 0.979 . . . . 21.52 111.907 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 22.4 t -62.05 -39.97 85.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 118.023 0.911 . . . . 71.530000000000001 109.863 -173.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 28.7 mtm -57.21 -42.1 80.7 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.483 -1.385 . . . . 61.340000000000003 111.491 172.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -61.76 -38.86 89.58 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 121.79 -0.569 . . . . 74.120000000000005 110.654 -177.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -50.89 61.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.371 -0.823 . . . . 72.239999999999995 110.515 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.556 ' CG ' HG22 ' A' ' 54' ' ' VAL . 11.5 m-85 -54.22 -32.68 56.46 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.557 0.947 . . . . 72.530000000000001 113.557 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -13.53 61.24 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 114.227 1.195 . . . . 72.209999999999994 114.227 175.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.237 0.419 0 C-N-CA 125.053 1.341 . . . . 73.109999999999999 108.497 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.698 0 N-CA-C 110.287 -1.125 . . . . 61.020000000000003 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -119.43 178.9 4.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.555 0.742 . . . . 61.310000000000002 110.845 177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -31.98 46.18 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.726 1.211 . . . . 75.420000000000002 113.769 -176.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -57.85 -33.9 69.15 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.358 1.063 . . . . 63.340000000000003 111.739 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -52.84 -56.72 13.74 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.298 1.039 . . . . 75.409999999999997 111.657 -172.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -57.93 -32.33 67.68 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.636 0.775 . . . . 75.099999999999994 111.536 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.0 m -67.18 -33.64 75.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 117.917 -1.039 . . . . 73.209999999999994 110.907 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.623 ' HG ' HD22 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -62.48 -39.81 94.64 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.698 2.044 . . . . 73.239999999999995 110.189 175.671 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.9 mm? -66.51 -16.56 64.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.502 0.721 . . . . 71.409999999999997 112.076 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -93.51 -39.4 10.89 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.498 1.919 . . . . 72.319999999999993 109.728 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.417 ' O ' ' HE2' ' A' ' 44' ' ' LYS . . . -70.35 8.0 0.9 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 129.805 3.242 . . . . 72.129999999999995 112.913 -174.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 109.47 -0.37 30.9 Favored Glycine 0 N--CA 1.439 -1.158 0 C-N-CA 124.979 1.276 . . . . 73.129999999999995 113.577 172.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -105.3 154.76 38.71 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 119.275 1.537 . . . . 72.0 112.329 -162.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -78.63 172.76 14.65 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.066 2.51 . . . . 62.409999999999997 111.789 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.459 ' HA ' HD11 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -74.24 -42.46 59.67 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 118.219 -0.896 . . . . 62.039999999999999 110.712 -174.09 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -64.72 -41.62 95.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 118.732 -1.187 . . . . 64.439999999999998 110.565 -167.213 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.9 t -58.07 -56.46 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 125.59 1.556 . . . . 55.100000000000001 108.739 168.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -37.16 67.85 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.037 0.754 . . . . 53.520000000000003 113.037 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.426 ' C ' ' HE3' ' A' ' 20' ' ' LYS . 3.8 mt-10 -63.33 -20.66 65.7 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.264 1.026 . . . . 73.019999999999996 112.744 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HE3' ' C ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -98.25 -32.48 11.54 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.23 0.923 . . . . 74.239999999999995 110.46 170.127 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.731 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -68.17 -31.67 71.38 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 125.116 1.366 . . . . 64.319999999999993 111.129 -175.857 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -54.52 -51.17 65.98 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 126.193 1.797 . . . . 71.219999999999999 112.033 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.91 -34.52 28.76 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.672 2.389 . . . . 52.219999999999999 112.503 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.9 mt -63.42 -28.17 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 108.447 -0.946 . . . . 73.420000000000002 108.447 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.731 ' HE2' HD23 ' A' ' 21' ' ' LEU . 34.6 m-85 -104.42 13.11 32.52 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.804 1.642 . . . . 74.140000000000001 112.805 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -111.06 -36.18 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.306 1.042 . . . . 73.209999999999994 109.912 173.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.93 9.62 3.45 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.009 -1.057 . . . . 74.150000000000006 112.981 -174.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.03 11.46 66.89 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 118.999 -0.889 . . . . 64.349999999999994 113.147 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.495 HD12 ' HE2' ' A' ' 59' ' ' LYS . 88.6 mt -66.12 -65.85 0.62 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.522 1.161 . . . . 61.450000000000003 108.121 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG23 ' CE1' ' A' ' 25' ' ' TYR . 27.3 m -135.45 164.02 34.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 O-C-N 123.238 0.336 . . . . 75.420000000000002 111.213 -173.674 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -90.15 155.2 19.2 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.208 1.003 . . . . 75.409999999999997 110.269 175.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -63.01 -23.81 67.63 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.259 -0.901 . . . . 63.340000000000003 112.209 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -100.5 12.88 36.32 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.76 1.022 . . . . 73.319999999999993 113.76 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.22 -26.35 62.0 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.601 -1.312 . . . . 75.439999999999998 112.579 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.9 mt -76.51 156.57 32.84 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.381 0.672 . . . . 71.349999999999994 110.835 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -110.25 173.59 6.26 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.834 1.653 . . . . 73.030000000000001 108.996 171.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -35.76 75.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 75.310000000000002 111.322 -164.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -66.02 -20.43 66.18 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 118.504 -0.76 . . . . 75.310000000000002 111.975 -176.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.64 18.52 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.309 0.959 . . . . 72.439999999999998 110.797 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.3 mm -67.09 -38.94 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 108.344 -0.984 . . . . 72.040000000000006 108.344 174.143 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -61.59 -45.56 93.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.481 -0.762 . . . . 74.319999999999993 110.473 172.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.13 -42.85 95.68 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.273 -0.394 . . . . 64.030000000000001 111.48 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.82 -49.08 74.23 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.978 0.911 . . . . 74.409999999999997 111.447 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -53.23 -19.53 3.21 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.818 1.647 . . . . 72.120000000000005 113.931 178.921 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.57 -20.36 26.55 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 120.168 1.349 . . . . 75.310000000000002 114.224 -170.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -90.0 152.38 21.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.141 0.976 . . . . 71.049999999999997 111.127 -165.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -74.03 -175.51 2.22 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.486 -1.234 . . . . 74.010000000000005 110.337 164.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -53.37 -68.0 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 124.71 1.204 . . . . 75.030000000000001 112.089 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -72.04 -35.3 69.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.086 -0.709 . . . . 73.409999999999997 109.086 -173.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.99 -46.12 70.02 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 110.93 -0.868 . . . . 75.120000000000005 110.93 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.17 -51.53 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 118.365 -0.826 . . . . 75.329999999999998 109.686 177.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.07 -43.45 70.29 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.01 0.924 . . . . 74.409999999999997 111.478 -178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.406 1.082 . . . . 70.010000000000005 111.027 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 89.6 t -57.69 -44.31 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 109.434 -0.58 . . . . 74.329999999999998 109.434 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -69.14 -49.12 59.84 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 123.487 0.715 . . . . 64.25 109.285 -173.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -51.35 -60.41 3.15 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 127.154 2.181 . . . . 61.109999999999999 108.298 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -63.86 -35.48 80.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.188 0.518 . . . . 71.230000000000004 110.649 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -66.53 -55.78 13.92 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.856 0.862 . . . . 71.340000000000003 110.891 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE2' HD12 ' A' ' 29' ' ' LEU . 2.0 ttmm -64.29 -29.71 70.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.777 0.831 . . . . 71.25 111.997 177.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -76.55 33.81 0.14 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.694 1.997 . . . . 65.530000000000001 111.299 172.304 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -140.93 171.57 13.89 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.645 2.378 . . . . 64.340000000000003 109.768 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -119.83 121.12 38.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.743 2.017 . . . . 64.450000000000003 106.696 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 22.1 mt -112.72 7.77 18.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.816 1.647 . . . . 75.049999999999997 112.213 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.4 t -58.67 -30.93 67.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.674 1.59 . . . . 71.010000000000005 111.724 -173.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -120.39 41.92 3.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 124.296 1.038 . . . . 75.040000000000006 109.424 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.6 t -129.74 111.05 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 124.37 1.068 . . . . 74.010000000000005 108.477 171.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -57.34 -64.28 0.94 Allowed 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.52 0.728 . . . . 75.439999999999998 109.571 171.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -81.25 89.36 6.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.831 0.824 . . . . 74.239999999999995 109.988 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -61.74 -37.01 82.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.615 -0.72 . . . . 75.129999999999995 111.112 178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 p -61.94 -56.28 20.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 124.656 1.182 . . . . 64.450000000000003 108.715 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.48 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . . . -63.01 -20.7 65.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.023 1.12 . . . . 40.549999999999997 114.023 -174.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -73.98 -56.37 5.03 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.641 -0.874 . . . . 64.030000000000001 108.641 174.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.664 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.9 OUTLIER -60.68 -48.51 81.48 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 125.077 1.351 . . . . 62.310000000000002 109.36 -172.396 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 71' ' ' ALA . 1.7 p -59.16 -30.58 68.27 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.198 -1.365 . . . . 72.239999999999995 109.443 -175.624 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.2 -45.36 71.34 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 125.039 1.304 . . . . 43.509999999999998 111.818 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.3 t -57.5 -40.79 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 118.964 1.382 . . . . 71.409999999999997 109.544 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.664 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -62.72 -36.18 82.16 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.828 -1.17 . . . . 74.219999999999999 110.931 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.0 tttp -62.69 -56.89 13.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.033 -0.729 . . . . 54.340000000000003 109.033 -176.081 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.94 -51.48 61.26 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.244 -0.884 . . . . 63.140000000000001 108.98 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.47 -33.84 73.17 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 115.355 1.613 . . . . 75.129999999999995 115.355 -173.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.12 -10.22 59.75 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.539 0.609 . . . . 75.030000000000001 111.22 177.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 . . . . . 0 N--CA 1.447 -0.597 0 C-N-CA 126.947 2.099 . . . . 42.450000000000003 109.333 -175.452 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.665 0 N-CA-C 111.439 -0.664 . . . . 75.5 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.35 179.38 7.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 122.562 1.172 . . . . 42.109999999999999 109.891 168.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -52.35 -31.8 35.29 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.612 2.365 . . . . 75.099999999999994 113.776 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -66.11 -34.73 78.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.12 0.568 . . . . 64.310000000000002 109.87 -172.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -45.12 -54.12 7.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.879 1.671 . . . . 73.150000000000006 111.998 -176.629 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -70.27 -39.69 74.79 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 112.199 0.444 . . . . 73.230000000000004 112.199 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.8 m -66.43 -34.42 77.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.115 0.566 . . . . 72.209999999999994 110.389 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.03 -48.22 77.16 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.293 -0.879 . . . . 75.540000000000006 110.308 171.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 21.8 mt -60.32 -21.38 61.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.928 0.891 . . . . 75.340000000000003 112.0 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -81.85 -28.38 33.06 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.286 0.634 . . . . 71.519999999999996 110.917 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.28 11.27 1.99 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.208 1.403 . . . . 64.340000000000003 112.11 -167.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.06 5.36 53.29 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 124.465 1.031 . . . . 71.230000000000004 112.48 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.8 mt -97.51 145.44 29.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 118.267 1.034 . . . . 62.409999999999997 111.022 -165.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.87 179.58 3.13 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 125.187 3.925 . . . . 72.230000000000004 112.72 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -54.91 8.83 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 120.567 -1.333 . . . . 75.430000000000007 109.026 172.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -65.39 -31.97 73.35 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 113.369 0.877 . . . . 74.209999999999994 113.369 -160.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.4 t -74.68 -54.09 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.738 -1.208 . . . . 72.25 107.738 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.17 -35.88 38.34 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.929 1.292 . . . . 51.32 112.033 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -36.14 68.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.098 0.959 . . . . 73.120000000000005 112.585 177.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.46 -34.96 16.25 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.082 -1.011 . . . . 74.230000000000004 110.16 172.107 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.546 HD12 HD21 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -73.19 -25.05 60.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.629 1.171 . . . . 64.519999999999996 112.715 -168.634 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -56.68 -47.6 79.49 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.071 0.948 . . . . 75.510000000000005 110.761 175.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.94 -30.45 64.03 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.939 1.695 . . . . 64.439999999999998 112.144 -174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.3 mt -64.58 -31.62 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.834 0.853 . . . . 44.340000000000003 109.328 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.482 ' HE2' HD23 ' A' ' 21' ' ' LEU . 81.2 m-85 -85.94 -21.73 27.77 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.506 0.558 . . . . 63.520000000000003 112.506 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 64.1 t -65.91 -50.94 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 118.694 0.679 . . . . 70.219999999999999 110.472 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.424 ' HB3' ' CD1' ' A' ' 29' ' ' LEU . . . -75.63 -7.25 53.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.628 0.771 . . . . 73.439999999999998 112.995 -161.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 80.93 29.66 41.33 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.637 -0.664 . . . . 61.509999999999998 112.398 -170.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.478 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.3 mt -76.34 -44.85 34.81 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-N 117.848 0.824 . . . . 73.120000000000005 109.411 173.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.3 m -144.96 149.38 16.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 118.256 0.48 . . . . 73.340000000000003 110.953 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.39 147.18 38.21 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.674 -0.861 . . . . 74.140000000000001 108.674 160.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -62.66 -43.62 98.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.944 -0.472 . . . . 74.430000000000007 110.161 171.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.6 m -79.89 19.56 0.68 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.085 0.772 . . . . 75.329999999999998 113.085 172.474 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.93 -42.47 48.72 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 120.319 1.418 . . . . 75.219999999999999 108.758 157.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -62.45 131.56 49.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.733 0.813 . . . . 71.340000000000003 110.054 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.86 170.1 10.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.719 1.207 . . . . 74.400000000000006 109.712 169.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.07 -30.56 62.16 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.046 1.338 . . . . 75.310000000000002 112.307 -173.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.48 -37.36 78.03 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.369 0.668 . . . . 63.409999999999997 110.928 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.82 34.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.632 0.773 . . . . 42.409999999999997 111.125 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.8 mm -58.71 -49.06 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.683 0.793 . . . . 72.540000000000006 109.183 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -55.63 -56.7 17.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.154 1.382 . . . . 61.229999999999997 109.76 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.56 75.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.724 0.809 . . . . 61.539999999999999 111.774 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mt -57.86 -38.01 74.92 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 113.007 0.743 . . . . 74.439999999999998 113.007 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.94 -32.89 74.82 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.566 0.621 . . . . 63.439999999999998 111.506 174.31 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -73.73 -15.6 61.21 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.006 0.743 . . . . 63.409999999999997 113.006 -171.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -89.18 132.85 34.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 119.076 0.853 . . . . 75.319999999999993 110.502 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -65.03 175.33 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.263 -1.335 . . . . 73.519999999999996 111.749 166.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -48.32 -64.07 0.9 Allowed 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.935 2.094 . . . . 74.519999999999996 111.788 -176.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.71 -36.69 57.03 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 122.831 0.452 . . . . 60.25 110.887 -175.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.61 -36.33 93.21 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 111.182 -0.767 . . . . 34.229999999999997 111.182 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.78 61.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.168 0.987 . . . . 53.020000000000003 109.911 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.09 -39.02 77.53 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.204 0.456 . . . . 75.25 110.286 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.42 91.89 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.292 0.637 . . . . 35.229999999999997 111.762 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -54.31 -44.35 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 109.42 -0.585 . . . . 75.120000000000005 109.42 173.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.546 HD21 HD12 ' A' ' 21' ' ' LEU . 19.9 mt -70.28 -47.05 62.94 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.339 -0.986 . . . . 72.409999999999997 108.339 -169.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -56.58 -56.17 24.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.46 1.504 . . . . 64.129999999999995 110.242 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -62.58 -41.0 98.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.408 1.099 . . . . 73.099999999999994 109.66 -174.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.66 -49.68 75.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 125.184 1.394 . . . . 75.420000000000002 110.797 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.478 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -71.39 -28.89 64.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.965 -1.084 . . . . 72.310000000000002 113.415 -179.235 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -75.73 -1.09 23.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.253 0.621 . . . . 72.219999999999999 111.463 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 m -83.77 172.05 12.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.585 1.539 . . . . 72.0 109.63 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -117.48 91.37 3.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.21 1.004 . . . . 71.329999999999998 110.301 -171.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.9 mt -79.99 -2.81 45.69 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.081 0.952 . . . . 62.32 113.417 -166.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.7 t -47.96 -60.92 2.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.174 1.79 . . . . 45.399999999999999 110.56 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -88.05 31.15 0.8 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.294 1.038 . . . . 73.319999999999993 111.899 -172.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -123.03 120.75 61.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 106.77 -1.567 . . . . 74.340000000000003 106.77 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -73.05 -51.01 19.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.874 0.87 . . . . 71.340000000000003 109.23 175.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -106.71 80.97 1.51 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 127.192 2.197 . . . . 72.530000000000001 108.195 -160.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -51.76 -37.4 51.15 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.262 -1.336 . . . . 74.239999999999995 111.251 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.9 p -64.08 -56.4 15.22 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 124.203 1.001 . . . . 73.239999999999995 109.824 -173.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.77 -36.34 72.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.33 0.652 . . . . 53.299999999999997 111.053 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.26 -53.82 46.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.69 -0.804 . . . . 71.099999999999994 109.499 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.59 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -60.47 -53.84 52.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.338 1.455 . . . . 44.240000000000002 109.598 -175.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.424 ' N ' HD13 ' A' ' 73' ' ' LEU . 8.1 t -62.0 -31.64 72.03 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.009 -0.996 . . . . 60.420000000000002 110.105 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.0 -49.22 68.31 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 118.932 -0.926 . . . . 62.340000000000003 111.411 169.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -59.18 -47.08 91.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 118.517 1.159 . . . . 63.200000000000003 109.527 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.59 ' CE ' HD11 ' A' ' 73' ' ' LEU . 35.3 mtt -53.41 -47.5 69.53 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.69 -0.631 . . . . 74.129999999999995 110.53 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -58.8 -45.48 89.8 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.838 -0.601 . . . . 75.530000000000001 110.049 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -47.05 86.79 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.852 0.751 . . . . 62.109999999999999 110.556 174.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -60.3 -42.94 96.58 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 113.056 0.762 . . . . 75.420000000000002 113.056 -177.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -69.02 -11.01 60.4 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.815 0.734 . . . . 72.519999999999996 111.339 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 . . . . . 0 N--CA 1.438 -1.049 0 C-N-CA 125.427 1.491 . . . . 73.510000000000005 110.107 -175.665 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.563 0 CA-C-O 121.253 0.363 . . . . 54.310000000000002 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.86 -173.95 4.87 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.575 1.95 . . . . 64.129999999999995 109.276 163.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.1 pm0 -77.33 -26.32 51.98 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 120.733 -1.229 . . . . 55.450000000000003 112.918 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -58.47 -20.49 45.78 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.281 0.946 . . . . 63.119999999999997 113.16 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -48.61 -46.89 40.18 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.526 1.131 . . . . 75.239999999999995 112.266 -176.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -65.99 -40.06 90.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.876 0.47 . . . . 75.129999999999995 111.5 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.2 m -59.9 -37.93 80.82 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.986 0.914 . . . . 75.439999999999998 110.31 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -72.27 -44.16 63.21 Favored 'General case' 0 CA--C 1.52 -0.194 0 C-N-CA 123.947 0.899 . . . . 52.25 111.253 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.67 -26.35 44.22 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.787 0.835 . . . . 62.009999999999998 111.351 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.96 -17.79 39.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.783 0.833 . . . . 74.430000000000007 112.632 -178.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.04 19.78 5.44 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.255 1.422 . . . . 73.219999999999999 113.72 -161.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.95 23.8 75.48 Favored Glycine 0 CA--C 1.525 0.667 0 O-C-N 121.577 -0.702 . . . . 54.43 112.512 -173.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.1 mt -112.06 146.17 34.28 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 124.959 1.304 . . . . 71.420000000000002 109.173 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.05 165.84 31.06 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.508 2.139 . . . . 62.130000000000003 111.09 177.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -60.17 -41.31 92.6 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.683 0.793 . . . . 73.450000000000003 108.891 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -58.02 -44.69 87.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.446 -0.797 . . . . 74.439999999999998 111.718 -171.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.4 t -70.94 -48.97 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.557 -1.275 . . . . 74.25 107.557 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.54 67.85 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.106 0.78 . . . . 72.25 113.106 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -50.35 -41.04 50.88 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.333 1.453 . . . . 75.140000000000001 113.893 172.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.52 -24.28 19.69 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 118.507 -0.759 . . . . 74.209999999999994 112.165 177.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.01 -34.52 43.93 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 118.962 0.801 . . . . 73.219999999999999 111.088 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -57.09 -41.35 78.71 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.872 0.844 . . . . 73.049999999999997 111.164 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -27.71 52.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 127.886 2.474 . . . . 74.219999999999999 112.446 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.464 HD13 ' HE3' ' A' ' 59' ' ' LYS . 23.3 mm -71.51 -37.3 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 N-CA-C 107.726 -1.213 . . . . 71.030000000000001 107.726 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -83.03 -10.52 58.7 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.454 1.102 . . . . 75.019999999999996 112.471 -176.125 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.3 t -73.77 -42.73 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 O-C-N 121.213 -0.929 . . . . 63.020000000000003 109.803 171.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.88 37.1 2.64 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.726 0.81 . . . . 53.539999999999999 112.152 -144.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.01 18.63 57.74 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 124.954 1.264 . . . . 74.340000000000003 115.085 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.2 mt -85.12 -65.78 0.97 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.348 1.074 . . . . 71.010000000000005 109.165 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.3 m -139.39 166.54 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.823 1.249 . . . . 74.230000000000004 110.369 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.49 162.93 12.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.234 1.413 . . . . 51.409999999999997 108.558 156.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -58.32 -35.36 71.76 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.847 0.748 . . . . 72.530000000000001 110.604 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.1 p -81.69 -5.31 57.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.537 1.135 . . . . 63.549999999999997 112.303 -174.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.61 -16.93 46.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.866 0.757 . . . . 63.409999999999997 112.471 -169.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -90.61 -175.24 4.36 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.133 1.773 . . . . 71.430000000000007 110.55 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -114.02 170.77 8.03 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.213 1.405 . . . . 72.519999999999996 109.828 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -46.57 -44.74 18.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.959 1.304 . . . . 72.409999999999997 110.608 164.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -64.49 -22.79 67.07 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.774 0.657 . . . . 62.240000000000002 112.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.28 -52.49 18.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.138 0.881 . . . . 24.530000000000001 109.902 171.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.02 -53.81 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 C-N-CA 125.144 1.377 . . . . 64.140000000000001 109.35 -175.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -64.02 -44.64 91.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.613 -0.232 . . . . 74.140000000000001 111.372 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.58 -38.52 87.83 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.178 -0.304 . . . . 75.340000000000003 110.178 -176.049 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 mt -52.59 -41.63 63.8 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.604 0.762 . . . . 75.120000000000005 111.952 173.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -59.22 -55.13 38.84 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.453 0.57 . . . . 74.420000000000002 110.081 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -74.18 -1.19 19.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 116.281 1.956 . . . . 73.310000000000002 116.281 -162.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.7 159.27 25.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.127 0.971 . . . . 74.329999999999998 110.309 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.7 p-10 -75.77 -179.65 4.9 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.185 0.994 . . . . 52.32 109.426 159.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -44.77 -70.87 0.09 Allowed 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 126.978 2.111 . . . . 75.239999999999995 110.722 171.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.26 -28.97 60.03 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 112.072 0.397 . . . . 75.049999999999997 112.072 -166.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.64 -40.44 94.04 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 110.416 -1.074 . . . . 62.450000000000003 110.416 174.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.75 -49.29 76.99 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.48 -0.771 . . . . 75.129999999999995 110.374 171.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.46 -38.85 72.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.589 1.086 . . . . 75.430000000000007 111.309 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -50.45 73.95 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.783 1.233 . . . . 71.349999999999994 111.069 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 63.2 t -52.28 -42.19 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.316 0.647 . . . . 72.25 110.141 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -71.49 -45.64 61.95 Favored 'General case' 0 CA--C 1.516 -0.345 0 O-C-N 122.345 -0.222 . . . . 60.329999999999998 110.414 -169.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -54.05 -56.86 14.01 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.88 1.272 . . . . 64.010000000000005 108.935 173.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -70.56 -6.68 38.26 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.099 0.777 . . . . 74.239999999999995 113.099 -168.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -93.87 -38.91 10.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.027 1.731 . . . . 74.150000000000006 111.701 174.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE3' HD13 ' A' ' 24' ' ' ILE . 4.9 mmtt -60.49 -35.27 75.53 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.64 1.109 . . . . 75.25 109.579 165.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -79.46 46.51 0.75 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.904 1.682 . . . . 64.019999999999996 109.077 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.2 m -153.76 167.07 30.84 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.304 -1.498 . . . . 74.420000000000002 111.705 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -99.78 116.33 31.62 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 126.529 1.932 . . . . 72.409999999999997 106.416 175.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.8 mt -114.03 8.7 17.16 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 126.589 1.956 . . . . 53.350000000000001 109.92 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 m -75.27 -58.82 3.05 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 126.978 2.111 . . . . 75.239999999999995 108.775 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -78.03 0.67 23.64 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 113.34 0.867 . . . . 75.349999999999994 113.34 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 48.9 t -82.7 141.25 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 120.937 -1.102 . . . . 60.140000000000001 109.819 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -69.13 0.54 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.428 1.491 . . . . 35.43 110.282 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -111.42 100.93 9.43 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 127.34 2.256 . . . . 73.450000000000003 107.912 -163.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -60.64 -31.98 71.17 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.495 1.118 . . . . 73.120000000000005 112.83 -165.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -57.0 -49.17 76.6 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.848 1.659 . . . . 74.150000000000006 108.757 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.12 -5.63 36.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 113.458 0.91 . . . . 20.329999999999998 113.458 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -91.0 -56.33 3.21 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 119.872 -0.731 . . . . 72.409999999999997 109.38 163.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.678 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -62.26 -50.8 70.27 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 126.117 1.767 . . . . 52.32 109.674 -165.555 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.7 t -55.09 -36.16 65.36 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.239 -1.346 . . . . 71.230000000000004 109.473 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.95 -42.04 97.06 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.002 -0.888 . . . . 73.140000000000001 112.7 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.7 t -60.53 -46.35 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 119.097 1.449 . . . . 54.219999999999999 108.653 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.678 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -58.54 -40.44 83.02 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.604 -0.685 . . . . 74.150000000000006 109.995 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -53.75 54.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.485 -0.769 . . . . 61.310000000000002 110.963 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -63.05 -42.94 99.84 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.7 -0.667 . . . . 63.25 109.788 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -60.09 -38.04 81.76 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.742 1.61 . . . . 75.040000000000006 112.523 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -21.33 59.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.592 0.757 . . . . 72.450000000000003 110.242 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 126.263 1.825 . . . . 72.349999999999994 111.423 -177.001 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.794 0 N-CA-C 111.384 -0.686 . . . . 72.0 111.384 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -96.36 -167.77 1.63 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.552 1.141 . . . . 75.420000000000002 110.28 166.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.07 -33.22 51.07 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 125.773 1.629 . . . . 71.109999999999999 113.264 -175.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.95 -41.93 97.24 Favored 'General case' 0 C--O 1.227 -0.114 0 C-N-CA 124.797 1.239 . . . . 64.439999999999998 110.168 -179.168 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -45.94 -60.93 1.97 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.945 1.698 . . . . 75.140000000000001 112.754 -170.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -63.38 -33.41 75.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.223 -0.417 . . . . 41.240000000000002 111.494 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.15 -39.61 86.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.462 -0.78 . . . . 73.230000000000004 109.364 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.12 96.07 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 120.011 1.278 . . . . 72.400000000000006 109.71 174.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.26 -16.81 61.44 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.996 0.918 . . . . 71.239999999999995 112.879 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -105.71 -17.79 14.28 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.26 1.824 . . . . 64.0 110.767 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.32 30.29 0.71 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 127.507 2.323 . . . . 74.400000000000006 110.813 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.455 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 82.38 3.2 90.63 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-O 117.784 -1.564 . . . . 71.099999999999994 114.277 173.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.2 mt -104.29 157.24 34.48 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.939 1.87 . . . . 42.420000000000002 112.92 -172.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.67 170.58 19.9 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 124.346 3.364 . . . . 63.299999999999997 113.739 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -66.4 -47.63 72.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 124.985 1.314 . . . . 55.130000000000003 109.728 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -42.52 86.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.16 0.43 . . . . 72.230000000000004 112.16 -166.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.93 -57.12 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 126.791 2.036 . . . . 63.109999999999999 107.285 173.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.14 -42.69 63.56 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 124.659 1.184 . . . . 73.140000000000001 112.491 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.11 -45.55 71.9 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.04 0.936 . . . . 74.329999999999998 110.217 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -38.54 28.07 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 119.289 -0.386 . . . . 75.439999999999998 110.6 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.33 -41.38 94.0 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.736 1.215 . . . . 75.019999999999996 110.88 -174.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.23 -44.31 75.34 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.885 1.274 . . . . 75.310000000000002 110.547 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -33.36 67.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.453 1.101 . . . . 73.439999999999998 112.858 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -66.93 -25.25 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.78 0.832 . . . . 64.329999999999998 109.483 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.68 -31.84 14.29 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.08 0.952 . . . . 73.409999999999997 111.855 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -53.19 -53.47 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.475 0.71 . . . . 74.400000000000006 110.883 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 1.75 17.13 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.755 0.65 . . . . 63.119999999999997 112.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.08 25.88 72.27 Favored Glycine 0 CA--C 1.528 0.885 0 O-C-N 120.782 -1.199 . . . . 54.539999999999999 112.88 174.363 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.469 HD13 ' HE2' ' A' ' 59' ' ' LYS . 1.8 mp -59.88 -43.88 94.5 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.203 1.501 . . . . 75.140000000000001 108.067 168.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -132.01 168.63 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 126.278 1.831 . . . . 75.239999999999995 108.224 167.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.97 161.29 13.81 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 107.862 -1.162 . . . . 73.200000000000003 107.862 165.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -59.28 -10.22 2.84 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.095 1.517 . . . . 75.230000000000004 115.095 -172.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.69 42.86 3.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.101 1.76 . . . . 63.299999999999997 109.73 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -74.47 -10.15 59.28 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 127.793 2.437 . . . . 64.239999999999995 113.647 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 mt -101.24 158.56 15.95 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 122.958 0.503 . . . . 71.340000000000003 112.142 -167.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -91.2 163.2 14.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.999 1.32 . . . . 74.030000000000001 109.351 167.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -46.99 -51.94 15.93 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.188 2.195 . . . . 71.420000000000002 111.784 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -76.79 -9.27 58.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.362 -0.828 . . . . 75.340000000000003 111.353 -172.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.26 -47.59 41.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.197 -1.382 . . . . 73.420000000000002 109.387 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.72 -52.09 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 120.597 1.544 . . . . 45.5 109.901 174.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.91 -40.44 88.82 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.969 0.729 . . . . 64.0 112.969 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.2 -23.24 54.65 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.502 1.046 . . . . 72.230000000000004 112.67 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.88 -32.03 73.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.16 0.984 . . . . 74.0 110.415 171.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.455 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 1.0 OUTLIER -62.13 -13.18 24.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.819 1.247 . . . . 72.0 112.89 174.13 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -104.85 2.99 30.54 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.047 0.939 . . . . 65.329999999999998 112.852 -171.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -97.47 160.25 14.44 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 120.626 -1.297 . . . . 63.240000000000002 109.98 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -86.73 178.4 7.03 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.349 1.46 . . . . 73.140000000000001 110.107 164.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -52.35 -68.04 0.2 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 127.275 2.23 . . . . 64.230000000000004 110.153 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.02 -34.0 77.08 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.92 -0.488 . . . . 75.120000000000005 111.781 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.456 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -61.39 -59.5 9.81 Favored Glycine 0 C--N 1.34 0.763 0 N-CA-C 109.616 -1.394 . . . . 52.240000000000002 109.616 177.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.86 -45.26 63.99 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.514 0.726 . . . . 71.310000000000002 111.891 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.63 -37.35 81.17 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.903 0.774 . . . . 74.409999999999997 111.761 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.91 -46.39 74.99 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.561 0.619 . . . . 73.109999999999999 110.321 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.521 HG22 ' CD2' ' A' ' 80' ' ' TYR . 10.2 t -57.62 -40.78 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 118.608 0.64 . . . . 73.019999999999996 110.747 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.99 -49.07 77.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.421 1.088 . . . . 75.400000000000006 109.824 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -57.53 -52.0 67.2 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.373 -0.83 . . . . 63.329999999999998 109.107 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -69.83 -26.21 64.12 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.425 0.557 . . . . 74.340000000000003 111.633 -170.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -62.14 -67.66 0.39 Allowed 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.951 -1.129 . . . . 73.0 107.951 168.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.469 ' HE2' HD13 ' A' ' 29' ' ' LEU . 4.4 tppp? -48.8 -37.28 18.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.192 0.997 . . . . 71.140000000000001 111.583 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -72.75 28.14 0.06 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.229 1.411 . . . . 60.130000000000003 112.935 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.8 m -142.27 157.84 44.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.733 1.613 . . . . 54.539999999999999 108.989 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.16 79.49 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 124.364 2.03 . . . . 72.329999999999998 108.423 -153.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.406 ' O ' ' HE2' ' A' ' 69' ' ' LYS . 70.0 mt -72.57 -0.2 12.19 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 127.24 2.216 . . . . 74.409999999999997 115.187 -165.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.4 t -56.4 -45.6 80.56 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.8 1.182 . . . . 74.430000000000007 111.368 -163.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -106.44 64.08 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.687 -0.857 . . . . 71.0 108.687 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.1 t -131.73 124.92 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 N-CA-C 106.87 -1.53 . . . . 53.329999999999998 106.87 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.513 ' CD ' ' H ' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -65.24 -54.27 31.8 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.686 0.794 . . . . 72.239999999999995 109.134 178.333 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -115.18 71.88 0.78 Allowed 'General case' 0 C--N 1.335 -0.065 0 C-N-CA 125.669 1.587 . . . . 75.319999999999993 110.741 -156.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HE2' ' O ' ' A' ' 63' ' ' LEU . 30.1 mmtp -46.95 -36.8 8.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 127.02 2.128 . . . . 64.109999999999999 112.916 178.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.31 -50.53 67.47 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 125.329 1.452 . . . . 62.039999999999999 111.077 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.9 71.93 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.967 0.507 . . . . 61.039999999999999 110.569 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -57.29 -54.96 40.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.625 -0.88 . . . . 72.200000000000003 108.625 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.41 -46.92 87.34 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.699 0.4 . . . . 75.140000000000001 110.532 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 33.1 t -53.55 -41.82 66.85 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.651 0.78 . . . . 54.229999999999997 110.856 177.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.58 -53.41 43.84 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.969 -0.853 . . . . 73.420000000000002 110.969 176.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -57.29 -45.38 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 123.222 0.609 . . . . 63.32 109.386 177.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.3 mtt -55.78 -44.33 77.63 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.969 -1.082 . . . . 74.409999999999997 111.717 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -57.16 -53.59 56.41 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 118.792 -0.623 . . . . 71.109999999999999 109.453 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 m -58.68 -43.26 89.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.351 0.407 . . . . 55.310000000000002 110.848 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.521 ' CD2' HG22 ' A' ' 54' ' ' VAL . 14.4 m-85 -61.92 -38.49 88.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.959 -1.088 . . . . 74.040000000000006 112.463 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.72 -11.58 59.84 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.711 -1.243 . . . . 74.019999999999996 112.438 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.232 0.146 0 C-N-CA 124.815 1.246 . . . . 61.229999999999997 109.481 -176.575 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 N-CA-C 109.443 -1.463 . . . . 71.150000000000006 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.65 -167.2 1.22 Allowed 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.937 -1.134 . . . . 50.25 107.937 161.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.97 -29.48 70.84 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.714 1.606 . . . . 74.310000000000002 112.348 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.46 -36.75 76.56 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.105 0.866 . . . . 73.540000000000006 110.264 -171.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -44.39 -53.4 6.86 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.495 1.918 . . . . 74.25 112.495 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.6 tp60 -61.88 -41.93 98.46 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 119.064 -0.493 . . . . 72.25 110.844 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.0 m -67.0 -37.28 83.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.539 -0.541 . . . . 64.140000000000001 109.539 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -36.75 82.44 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.281 -0.887 . . . . 63.229999999999997 111.295 176.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -23.33 67.22 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.365 0.53 . . . . 64.430000000000007 111.084 176.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -87.85 -24.28 23.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.962 0.801 . . . . 72.239999999999995 112.08 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.38 11.99 1.38 Allowed 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.101 2.161 . . . . 54.43 112.724 -164.486 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 16.12 46.29 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-O 117.954 -1.47 . . . . 71.239999999999995 114.168 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.7 mt -119.79 157.02 53.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.773 1.286 . . . . 71.450000000000003 113.184 -171.228 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.23 172.49 15.95 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 124.657 3.571 . . . . 72.519999999999996 113.178 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -73.45 -43.72 59.72 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.972 1.309 . . . . 74.239999999999995 110.278 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.91 -38.48 72.91 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.992 -0.283 . . . . 71.239999999999995 111.611 -171.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.3 t -70.74 -52.31 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 127.227 2.211 . . . . 73.340000000000003 107.146 176.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.02 -42.25 62.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.889 1.275 . . . . 70.120000000000005 112.112 -173.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -52.79 -55.04 25.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 73.530000000000001 110.39 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.55 -27.26 58.58 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 118.568 -0.73 . . . . 74.319999999999993 111.308 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.3 tp -74.69 -41.63 59.9 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.001 0.92 . . . . 62.329999999999998 110.994 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -54.65 -45.97 73.89 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.06 0.944 . . . . 73.530000000000001 110.121 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -37.57 28.6 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 126.999 2.12 . . . . 63.439999999999998 112.403 176.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.41 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 108.688 -0.856 . . . . 72.109999999999999 108.688 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 19.7 m-85 -80.98 -4.03 53.67 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.884 1.274 . . . . 74.129999999999995 112.74 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 42.2 t -85.42 -44.49 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.787 1.176 . . . . 75.549999999999997 110.752 175.554 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.83 -4.29 42.84 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.1 0.778 . . . . 72.530000000000001 113.1 -162.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.12 -14.84 64.55 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 125.202 1.382 . . . . 62.240000000000002 113.179 -176.33 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.427 HD12 ' HE2' ' A' ' 59' ' ' LYS . 87.9 mt -53.47 -51.66 62.02 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.681 1.593 . . . . 61.420000000000002 110.951 -172.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 69' ' ' LYS . 5.8 m -136.47 160.09 37.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 O-C-N 123.532 0.52 . . . . 63.25 111.899 168.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.46 159.68 20.72 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 108.504 -0.924 . . . . 74.430000000000007 108.504 156.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.426 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 29.1 p80 -59.97 -31.44 69.9 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.934 -0.555 . . . . 61.43 112.088 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.74 2.05 55.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.373 -0.823 . . . . 73.120000000000005 112.331 179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -77.34 15.04 0.81 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.583 1.538 . . . . 54.310000000000002 112.694 -177.011 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 51.3 mt -118.09 -170.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.43 2.692 . . . . 74.150000000000006 106.747 -174.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -132.55 172.63 12.25 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 107.48 -1.304 . . . . 74.409999999999997 107.48 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -52.76 -36.61 58.22 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.668 0.787 . . . . 63.240000000000002 110.825 171.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -54.63 -32.09 58.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.689 -0.632 . . . . 72.510000000000005 112.37 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.77 -46.01 22.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.565 0.746 . . . . 61.329999999999998 110.963 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.1 mm -55.23 -53.16 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 N-CA-C 107.97 -1.122 . . . . 74.549999999999997 107.97 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.43 -45.16 95.49 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 125.102 1.361 . . . . 74.510000000000005 110.336 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.58 84.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.329 -0.843 . . . . 74.549999999999997 111.918 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.33 -38.83 81.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.239 0.927 . . . . 73.230000000000004 111.533 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -61.09 -44.87 96.7 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.145 0.429 . . . . 65.25 109.942 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -69.3 11.99 0.2 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 128.921 2.888 . . . . 73.140000000000001 116.1 -165.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -118.33 154.27 32.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.858 1.263 . . . . 62.140000000000001 109.55 -175.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.18 176.9 0.1 Allowed 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 122.887 1.327 . . . . 63.100000000000001 112.141 155.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -52.23 -65.71 0.51 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.958 2.503 . . . . 70.219999999999999 110.313 165.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -32.97 66.51 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.369 0.986 . . . . 50.450000000000003 111.973 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.08 -57.24 10.29 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.34 0.971 . . . . 53.25 111.023 168.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.45 -42.87 97.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.659 -0.686 . . . . 74.420000000000002 111.297 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.86 -50.26 69.51 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 117.733 -1.127 . . . . 71.540000000000006 110.728 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.28 -45.91 69.08 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.632 1.106 . . . . 61.140000000000001 111.534 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.41 HG11 ' HG2' ' A' ' 77' ' ' MET . 55.7 t -53.87 -43.12 56.0 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 124.507 1.123 . . . . 74.310000000000002 111.556 175.698 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -72.17 -42.53 65.8 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 122.985 0.514 . . . . 71.439999999999998 109.994 -175.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -71.25 -41.09 70.56 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 122.49 0.316 . . . . 75.129999999999995 110.834 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -69.31 -17.62 63.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.404 -0.518 . . . . 62.409999999999997 111.157 173.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.477 ' CD2' HD23 ' A' ' 73' ' ' LEU . 16.6 t80 -84.95 -41.45 15.89 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-O 119.418 -0.325 . . . . 70.530000000000001 110.324 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.427 ' HE2' HD12 ' A' ' 29' ' ' LEU . 6.6 ttmt -70.91 -19.92 62.54 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.881 0.764 . . . . 75.450000000000003 111.362 172.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -75.49 48.23 0.43 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.301 1.44 . . . . 71.340000000000003 109.753 168.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.4 m -149.58 152.55 35.67 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.629 -1.919 . . . . 71.519999999999996 112.411 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -93.37 78.55 4.43 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.271 1.428 . . . . 63.43 107.498 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -79.96 -11.86 59.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.181 -0.918 . . . . 74.219999999999999 111.064 -168.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 m -53.1 -30.99 39.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.862 2.065 . . . . 75.219999999999999 112.07 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.7 m80 -100.21 14.01 32.31 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.352 1.061 . . . . 64.340000000000003 113.862 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.2 t -105.17 135.14 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 121.574 -0.704 . . . . 52.149999999999999 109.841 -176.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -68.48 0.32 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.37 1.868 . . . . 61.25 110.534 176.046 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -111.61 88.92 2.92 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.34 1.456 . . . . 63.450000000000003 109.692 -166.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB3' HG12 ' A' ' 30' ' ' VAL . 38.9 mmtm -53.21 -31.6 43.87 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.195 1.398 . . . . 71.439999999999998 114.07 -172.746 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.53 25.92 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 128.473 2.709 . . . . 72.150000000000006 109.085 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.12 89.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.495 0.718 . . . . 73.230000000000004 110.146 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.97 -51.03 69.71 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.33 -0.619 . . . . 63.520000000000003 109.33 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.561 HD21 ' HE3' ' A' ' 77' ' ' MET . 0.2 OUTLIER -62.05 -57.57 11.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.473 1.109 . . . . 70.120000000000005 108.622 -175.766 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 2.8 t -62.22 -27.1 68.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.637 -0.71 . . . . 52.43 110.583 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.07 -53.69 40.71 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.855 0.741 . . . . 72.140000000000001 111.405 168.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -54.52 -49.26 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 118.285 1.042 . . . . 74.439999999999998 108.545 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.561 ' HE3' HD21 ' A' ' 73' ' ' LEU . 18.2 mtt -50.59 -54.04 25.82 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.617 0.767 . . . . 73.409999999999997 110.744 177.208 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -62.56 -43.99 97.44 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.802 -0.444 . . . . 74.549999999999997 109.802 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -58.6 -47.5 84.12 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.397 0.679 . . . . 70.219999999999999 109.607 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -64.06 -44.01 93.74 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.342 0.519 . . . . 74.530000000000001 111.924 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -62.44 -50.74 70.26 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.054 -0.721 . . . . 73.340000000000003 109.054 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 CA--C 1.535 0.371 0 CA-C-O 122.836 1.303 . . . . 72.299999999999997 110.011 172.434 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.88 0 N-CA-C 109.959 -1.256 . . . . 73.530000000000001 109.959 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.34 -176.61 3.03 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.919 1.288 . . . . 72.120000000000005 109.588 -168.117 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -50.99 -37.48 45.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.442 1.097 . . . . 74.230000000000004 112.459 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -35.27 76.3 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.56 -0.904 . . . . 62.140000000000001 108.56 -168.115 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -44.08 -53.39 6.42 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.896 1.678 . . . . 72.530000000000001 111.541 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -66.58 -43.5 84.79 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.861 -0.336 . . . . 61.420000000000002 110.664 -175.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.5 m -61.65 -38.59 88.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.25 0.62 . . . . 73.230000000000004 109.882 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.85 78.63 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.656 1.583 . . . . 55.32 111.692 178.219 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.88 -25.49 65.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.344 0.975 . . . . 64.120000000000005 110.135 173.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.89 -11.59 26.47 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.411 1.005 . . . . 73.010000000000005 111.905 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.15 13.03 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.829 -1.17 . . . . 74.219999999999999 112.184 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 106.36 1.89 38.08 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 124.49 1.043 . . . . 51.420000000000002 113.622 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.1 mt -100.17 144.84 29.17 Favored Pre-proline 0 N--CA 1.448 -0.563 0 C-N-CA 124.013 0.925 . . . . 74.510000000000005 108.688 -160.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' HG23 ' A' ' 17' ' ' VAL . 73.9 Cg_endo -69.61 164.23 35.16 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 121.639 1.559 . . . . 71.239999999999995 110.496 176.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -62.46 -46.81 86.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.28 -1.007 . . . . 74.200000000000003 108.28 -178.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -36.91 71.0 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 114.219 1.192 . . . . 75.340000000000003 114.219 -174.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . 0.402 HG23 ' HG2' ' A' ' 14' ' ' PRO . 57.4 t -73.96 -52.47 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 107.049 -1.463 . . . . 72.200000000000003 107.049 174.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.2 -36.09 51.02 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.381 1.073 . . . . 52.210000000000001 112.589 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.62 -56.18 15.05 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.531 0.733 . . . . 62.200000000000003 110.738 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.81 -32.88 57.93 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 115.839 -0.618 . . . . 71.329999999999998 110.389 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.54 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -71.58 -32.25 67.85 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.451 1.1 . . . . 62.549999999999997 111.185 -174.401 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.59 -45.17 85.61 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.006 1.322 . . . . 75.439999999999998 111.567 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -27.45 66.66 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.473 1.109 . . . . 75.409999999999997 112.975 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.77 -17.23 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.66 -0.65 . . . . 75.540000000000006 109.509 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.54 ' HE2' HD23 ' A' ' 21' ' ' LEU . 64.7 m-85 -97.99 -0.96 43.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.644 1.178 . . . . 75.319999999999993 113.227 175.38 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.0 t -84.1 -55.6 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.191 -0.943 . . . . 75.230000000000004 109.078 175.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.06 36.42 1.21 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.513 1.525 . . . . 61.119999999999997 111.469 -151.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 59.28 27.95 63.7 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.378 1.466 . . . . 63.119999999999997 115.156 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.437 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 38.5 mt -85.44 -66.02 0.95 Allowed 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.789 0.836 . . . . 74.540000000000006 109.207 176.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.99 161.73 35.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.078 0.551 . . . . 60.409999999999997 110.789 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.25 158.6 15.51 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.644 2.378 . . . . 60.140000000000001 109.588 158.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -58.17 -31.94 67.73 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.204 0.456 . . . . 75.230000000000004 111.911 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.4 t -95.21 10.32 36.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.563 0.745 . . . . 63.229999999999997 111.959 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -83.03 -12.12 57.49 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 120.679 -1.263 . . . . 74.420000000000002 111.193 169.261 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.98 179.4 5.97 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.964 2.106 . . . . 51.219999999999999 109.91 174.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 p30 -139.34 -175.92 4.35 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.526 1.13 . . . . 62.130000000000003 110.373 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -55.73 -36.48 67.3 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.388 -0.82 . . . . 75.019999999999996 111.642 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.0 mtm-85 -66.73 -18.71 65.51 Favored 'General case' 0 C--N 1.338 0.076 0 CA-C-O 118.859 -0.591 . . . . 75.150000000000006 111.294 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.72 -51.92 11.64 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.491 1.042 . . . . 53.119999999999997 109.93 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.4 mm -60.8 -50.44 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.225 1.41 . . . . 75.129999999999995 110.372 -173.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.22 -44.07 76.55 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.626 -0.509 . . . . 74.239999999999995 109.626 -174.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.88 82.04 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 122.761 0.424 . . . . 64.200000000000003 111.748 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.42 -45.86 80.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.466 0.575 . . . . 71.450000000000003 111.259 178.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -20.61 66.14 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.098 -0.953 . . . . 73.120000000000005 111.733 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' CD ' HH21 ' A' ' 81' ' ' ARG . 2.1 mt-10 -85.42 43.7 1.04 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.423 1.465 . . . . 71.409999999999997 111.876 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -139.79 156.32 46.82 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.961 -1.087 . . . . 73.200000000000003 110.053 170.081 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -84.99 178.13 7.69 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.547 0.739 . . . . 71.439999999999998 109.947 165.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -49.41 -56.39 9.81 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.088 1.755 . . . . 71.409999999999997 112.04 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -81.41 -34.1 31.78 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.028 -0.42 . . . . 71.420000000000002 111.625 -172.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.48 87.07 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 111.544 -0.622 . . . . 71.209999999999994 111.544 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.96 69.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.947 1.299 . . . . 73.540000000000006 109.567 168.595 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.8 mt -63.52 -35.27 79.93 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 118.061 -0.971 . . . . 75.109999999999999 111.502 -178.141 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.38 87.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.527 1.058 . . . . 35.509999999999998 110.853 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -54.66 -41.64 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 121.618 -0.677 . . . . 64.439999999999998 110.444 173.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.7 mt -78.27 -33.19 49.74 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.403 -0.811 . . . . 75.310000000000002 110.45 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -54.89 -62.5 1.61 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 107.228 -1.397 . . . . 75.340000000000003 107.228 167.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -72.97 -10.06 59.4 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.471 0.915 . . . . 74.420000000000002 113.471 -164.854 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -84.18 -61.31 1.84 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.867 0.867 . . . . 60.32 110.535 172.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 13.4 ttmt -63.79 -30.1 71.23 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.519 1.054 . . . . 74.230000000000004 110.573 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -81.88 57.51 3.48 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 124.381 1.073 . . . . 75.310000000000002 109.959 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 75.7 m -153.8 177.31 11.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.055 2.142 . . . . 73.430000000000007 107.78 161.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -115.75 105.72 13.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.827 2.051 . . . . 74.540000000000006 106.614 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.2 mt -94.59 7.25 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.049 0.939 . . . . 71.349999999999994 111.985 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.2 m -53.83 126.47 22.3 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.901 -0.777 . . . . 52.049999999999997 108.901 165.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 18.5 m80 59.39 10.26 1.75 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.447 1.899 . . . . 72.510000000000005 114.869 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.26 135.79 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 107.357 -1.349 . . . . 72.040000000000006 107.357 170.086 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -54.17 -85.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.214 1.806 . . . . 53.420000000000002 111.479 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.49 99.96 7.0 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.738 -1.578 . . . . 71.230000000000004 106.738 -162.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -62.89 -28.62 70.17 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.586 1.154 . . . . 74.049999999999997 111.232 -169.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -51.38 66.64 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.304 1.842 . . . . 52.530000000000001 109.26 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.01 -24.41 59.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.736 -0.649 . . . . 73.420000000000002 112.085 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -67.07 -56.55 9.57 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 107.053 -1.462 . . . . 64.030000000000001 107.053 171.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.689 HD11 ' HE2' ' A' ' 77' ' ' MET . 0.9 OUTLIER -55.73 -52.54 63.56 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.717 1.607 . . . . 64.439999999999998 110.118 -173.908 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 49.5 t -61.96 -28.03 69.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.559 -0.746 . . . . 61.039999999999999 110.216 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.67 -47.3 91.24 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.415 -0.803 . . . . 62.130000000000003 111.397 173.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.0 t -54.55 -53.68 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 123.944 0.898 . . . . 63.350000000000001 109.023 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.689 ' HE2' HD11 ' A' ' 73' ' ' LEU . 2.2 mtt -56.2 -50.1 72.18 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.015 0.526 . . . . 75.040000000000006 110.97 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -54.22 -51.0 65.85 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.649 -0.5 . . . . 75.010000000000005 109.649 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -54.59 -48.5 72.08 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 124.514 1.134 . . . . 72.430000000000007 109.897 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -64.21 -44.11 92.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.183 0.901 . . . . 75.230000000000004 112.55 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.432 HH21 ' CD ' ' A' ' 45' ' ' GLU . 3.9 ttt-85 -70.79 -19.42 62.69 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.186 0.903 . . . . 75.209999999999994 111.457 178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 C--N 1.329 -0.3 0 CA-C-O 122.823 1.297 . . . . 73.109999999999999 108.944 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.449 0 N-CA-C 110.595 -1.002 . . . . 61.539999999999999 110.595 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -137.11 -167.87 2.18 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.544 -0.539 . . . . 63.530000000000001 109.544 -173.161 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.04 23.52 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.606 -1.309 . . . . 50.43 114.32 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.7 -32.97 9.11 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 127.23 2.212 . . . . 72.450000000000003 110.457 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -54.43 -59.38 4.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.516 1.127 . . . . 74.239999999999995 112.456 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 tp60 -59.42 -28.8 67.26 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.419 1.088 . . . . 74.209999999999994 111.754 -174.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -59.54 -40.52 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.0 0.92 . . . . 62.450000000000003 109.509 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.91 -39.38 87.38 Favored 'General case' 0 C--N 1.342 0.27 0 O-C-N 121.672 -0.642 . . . . 64.129999999999995 110.97 177.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 15' ' ' GLN . 3.4 mm? -64.41 -20.83 66.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.666 -0.683 . . . . 72.329999999999998 110.373 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.55 -6.02 41.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.508 1.123 . . . . 71.430000000000007 110.814 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.78 15.27 5.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 119.3 -2.125 . . . . 71.349999999999994 112.306 -175.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.94 11.84 64.68 Favored Glycine 0 CA--C 1.526 0.772 0 O-C-N 121.029 -1.044 . . . . 63.530000000000001 113.547 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.417 HD11 HD13 ' A' ' 43' ' ' LEU . 61.6 mt -116.06 160.7 34.44 Favored Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 118.861 1.331 . . . . 63.409999999999997 113.507 -161.716 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.14 172.97 12.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.463 2.775 . . . . 61.049999999999997 111.557 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.428 ' HA ' HD11 ' A' ' 9' ' ' LEU . 7.9 tt0 -70.54 -48.0 57.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 118.402 -0.809 . . . . 74.209999999999994 110.349 169.574 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -53.91 -36.1 62.37 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.271 0.841 . . . . 70.019999999999996 113.271 -163.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -70.67 -55.39 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 C-N-CA 127.889 2.475 . . . . 74.030000000000001 107.978 177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.12 -41.09 16.83 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.83 1.252 . . . . 64.409999999999997 112.162 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -61.63 -21.52 64.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.957 1.466 . . . . 74.439999999999998 114.957 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.93 -21.23 11.24 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.568 0.543 . . . . 61.25 112.343 170.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.97 -28.11 65.27 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.214 1.006 . . . . 74.219999999999999 111.449 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -52.08 -45.83 64.94 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.292 1.437 . . . . 70.150000000000006 111.7 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -65.1 -27.98 69.13 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 127.288 2.235 . . . . 74.349999999999994 114.124 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.597 HG22 HG22 ' A' ' 30' ' ' VAL . 17.1 mm -57.48 -32.94 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.144 -0.687 . . . . 70.140000000000001 109.144 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CE1' HG23 ' A' ' 30' ' ' VAL . 68.1 m-85 -82.42 -49.92 9.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.4 1.08 . . . . 71.510000000000005 110.088 177.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.6 t -51.74 -41.83 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.495 0.718 . . . . 63.130000000000003 112.195 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.2 7.82 3.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.694 1.198 . . . . 71.120000000000005 112.113 -171.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.74 -2.27 59.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.119 0.866 . . . . 44.200000000000003 113.036 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.424 HD12 ' HE2' ' A' ' 59' ' ' LYS . 59.6 mt -66.61 -52.11 48.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 124.136 0.974 . . . . 70.310000000000002 109.353 -172.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.597 HG22 HG22 ' A' ' 24' ' ' ILE . 30.7 m -132.64 162.84 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.721 1.008 . . . . 73.109999999999999 113.721 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -99.64 155.68 17.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.412 1.485 . . . . 63.299999999999997 109.271 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -70.34 -12.55 61.66 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.466 0.913 . . . . 64.409999999999997 113.466 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.3 m -118.63 18.4 13.46 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.576 1.15 . . . . 45.020000000000003 111.916 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -68.84 -30.09 68.55 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.311 -0.868 . . . . 71.129999999999995 110.228 169.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.07 127.29 32.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.067 1.347 . . . . 73.209999999999994 108.902 -175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -83.53 164.08 20.03 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.431 -1.322 . . . . 70.400000000000006 107.431 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -44.6 -44.2 8.71 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.067 2.147 . . . . 65.0 113.263 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -51.07 -38.18 50.07 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.876 1.27 . . . . 73.099999999999994 113.368 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -84.28 -28.1 27.4 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.111 0.965 . . . . 73.319999999999993 111.604 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.0 mm -67.6 -45.24 85.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 109.493 -0.558 . . . . 51.140000000000001 109.493 176.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -57.92 -49.09 77.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 109.398 -0.593 . . . . 63.340000000000003 109.398 172.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.28 77.59 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 118.756 -0.64 . . . . 73.010000000000005 111.419 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 43' ' ' LEU . 4.9 mt -56.64 -51.54 68.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 120.197 1.362 . . . . 74.400000000000006 112.688 173.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -58.06 -17.12 15.73 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.565 0.95 . . . . 74.109999999999999 113.565 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.64 -20.63 53.49 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 120.517 1.508 . . . . 72.299999999999997 114.819 -170.548 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -94.95 160.93 14.36 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.168 0.985 . . . . 62.43 110.979 -168.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -85.09 178.86 7.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.915 1.286 . . . . 73.239999999999995 110.794 166.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -36.54 66.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.72 1.608 . . . . 65.219999999999999 113.628 -172.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.13 -34.34 10.79 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.269 1.427 . . . . 74.129999999999995 109.929 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.31 -43.49 97.25 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.016 -0.834 . . . . 50.539999999999999 111.016 178.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.26 81.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.874 1.27 . . . . 63.299999999999997 109.783 173.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 mp -61.96 -30.82 71.18 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.939 0.895 . . . . 74.340000000000003 111.727 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.75 82.48 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.312 0.96 . . . . 50.200000000000003 111.654 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -55.07 -41.06 57.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 109.134 -0.691 . . . . 64.420000000000002 109.134 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.55 -51.29 29.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 118.78 -0.629 . . . . 72.010000000000005 110.42 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.62 -20.72 65.9 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.038 0.535 . . . . 74.439999999999998 112.41 -174.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -87.68 -40.01 14.52 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.636 0.375 . . . . 64.230000000000004 110.937 171.653 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' PHE . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 73' ' ' LEU . 61.4 t80 -77.16 -36.1 55.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.554 0.946 . . . . 74.129999999999995 113.554 -173.173 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.424 ' HE2' HD12 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -58.18 -37.77 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.711 -1.243 . . . . 71.239999999999995 109.218 169.422 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -83.44 2.22 37.74 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.123 2.169 . . . . 71.099999999999994 112.112 -173.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m -82.61 152.29 25.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.622 1.201 . . . . 65.219999999999999 111.914 174.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -83.29 53.81 2.6 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.439 2.296 . . . . 73.420000000000002 109.19 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.44 -0.49 12.68 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.843 1.423 . . . . 74.120000000000005 114.843 -163.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.4 m -58.06 -59.71 4.85 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.842 1.201 . . . . 62.299999999999997 110.479 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -84.8 53.08 2.59 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.385 1.074 . . . . 65.310000000000002 110.389 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.4 t -133.23 121.06 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 106.709 -1.589 . . . . 62.030000000000001 106.709 170.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.45 -56.54 4.36 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.29 0.95 . . . . 73.430000000000007 109.612 169.535 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -77.05 72.82 3.62 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.02 1.328 . . . . 71.099999999999994 110.705 -172.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -57.79 -39.02 76.54 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.994 -0.441 . . . . 73.200000000000003 112.052 -176.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.87 -52.72 55.08 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 127.839 2.456 . . . . 70.219999999999999 108.457 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.29 79.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.907 -0.588 . . . . 74.340000000000003 110.843 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -62.61 -50.37 71.52 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 109.339 -0.615 . . . . 74.430000000000007 109.339 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' CE ' ' A' ' 77' ' ' MET . 1.3 tm? -59.52 -52.06 67.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.938 0.895 . . . . 65.239999999999995 109.819 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.8 t -58.36 -37.93 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.306 -0.861 . . . . 72.109999999999999 109.502 -177.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.03 -45.04 95.82 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.557 1.075 . . . . 42.200000000000003 113.167 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.47 -39.51 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 119.332 1.566 . . . . 71.409999999999997 109.587 174.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.648 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.6 mtt -62.72 -35.42 79.7 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.287 -1.508 . . . . 71.420000000000002 111.285 176.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 78' ' ' LYS . 15.3 mtpp -62.93 -46.01 89.81 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 118.461 -0.78 . . . . 65.340000000000003 111.398 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 t -62.14 -47.85 82.72 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 119.667 1.121 . . . . 71.319999999999993 108.414 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -63.81 -32.66 74.24 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.093 1.516 . . . . 73.129999999999995 115.093 -170.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -77.94 -29.55 50.02 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.969 1.259 . . . . 74.319999999999993 112.308 169.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 . . . . . 0 C--O 1.238 0.464 0 C-N-CA 124.519 1.128 . . . . 74.329999999999998 109.122 -171.562 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.352 0 N-CA-C 108.576 -1.81 . . . . 61.030000000000001 108.576 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 m -97.89 -170.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 123.696 0.798 . . . . 62.020000000000003 110.429 -177.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -61.53 -10.14 7.34 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 114.597 1.332 . . . . 63.5 114.597 -175.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -70.69 -43.21 69.51 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 120.305 1.412 . . . . 74.400000000000006 108.679 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -47.02 -56.84 5.74 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.65 1.58 . . . . 73.209999999999994 112.622 -173.12 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -59.99 -42.66 94.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.506 0.323 . . . . 73.319999999999993 110.958 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -69.83 -36.88 75.96 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 119.03 -0.51 . . . . 74.310000000000002 109.734 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -39.42 91.89 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.744 1.156 . . . . 71.319999999999993 111.493 175.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 15' ' ' GLN . 22.1 mt -63.29 -27.47 69.36 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.104 0.561 . . . . 73.109999999999999 111.131 176.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -90.94 -29.83 17.22 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.325 0.65 . . . . 75.120000000000005 110.965 177.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.68 -15.6 41.53 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.029 2.132 . . . . 60.229999999999997 111.661 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.429 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 127.04 4.93 5.86 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-O 117.411 -1.772 . . . . 74.430000000000007 114.936 167.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.9 mt -98.78 153.87 37.68 Favored Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 118.795 1.297 . . . . 73.140000000000001 111.387 -169.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.48 165.91 29.03 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.932 2.421 . . . . 64.040000000000006 111.288 171.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.515 ' HA ' HD21 ' A' ' 9' ' ' LEU . 25.9 tt0 -61.73 -40.37 94.85 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 124.463 1.105 . . . . 64.140000000000001 109.981 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -59.01 -51.29 70.71 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 123.913 0.758 . . . . 61.240000000000002 110.2 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.5 -50.71 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.904 1.282 . . . . 53.100000000000001 107.789 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.37 -41.45 76.24 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.574 0.624 . . . . 74.030000000000001 112.373 -176.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.53 -40.19 78.26 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.245 1.018 . . . . 71.409999999999997 110.865 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.89 -35.49 32.49 Favored 'General case' 0 C--O 1.231 0.089 0 O-C-N 121.828 -0.545 . . . . 42.420000000000002 110.03 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.8 tp -77.52 -36.96 51.92 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.926 -0.559 . . . . 74.400000000000006 112.313 -170.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -54.27 -40.9 68.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.773 0.715 . . . . 64.120000000000005 111.313 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -58.38 -33.72 69.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 128.32 2.648 . . . . 70.230000000000004 111.856 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.7 mm -58.78 -40.13 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 125.039 1.336 . . . . 65.340000000000003 109.728 178.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.64 -47.07 16.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.166 0.586 . . . . 73.409999999999997 109.98 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 93.1 t -53.68 -46.15 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.678 0.791 . . . . 72.329999999999998 111.174 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.74 -1.18 13.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.348 0.87 . . . . 73.120000000000005 113.348 -176.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.07 32.23 44.99 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 124.292 0.948 . . . . 21.41 112.355 171.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.59 -85.2 0.07 Allowed 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.826 -1.546 . . . . 72.010000000000005 106.826 170.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -103.2 175.92 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.441 1.096 . . . . 71.239999999999995 110.194 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.47 15.95 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.785 . . . . 63.310000000000002 111.447 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -64.43 -9.1 16.14 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.464 1.105 . . . . 61.530000000000001 113.857 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.1 t -124.06 8.79 8.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.213 1.805 . . . . 64.0 110.149 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.9 -15.71 63.12 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.515 0.932 . . . . 74.030000000000001 113.515 -167.25 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -101.55 151.0 22.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.901 0.88 . . . . 63.119999999999997 111.75 -159.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -81.95 159.3 23.62 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.246 -1.39 . . . . 35.350000000000001 107.246 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.13 -28.85 69.93 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.702 -0.624 . . . . 60.109999999999999 112.515 -174.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.367 -0.833 . . . . 74.430000000000007 112.261 175.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.33 -30.05 60.18 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.969 -0.382 . . . . 74.239999999999995 109.969 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mm -64.99 -53.02 46.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.097 -0.705 . . . . 73.099999999999994 109.097 170.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.27 -47.38 84.61 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.237 1.015 . . . . 75.150000000000006 111.062 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.13 69.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.05 -0.406 . . . . 75.230000000000004 111.7 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.7 mt -56.95 -44.85 82.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.597 0.635 . . . . 63.43 111.816 171.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.429 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.4 OUTLIER -54.46 -20.13 7.01 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.566 1.146 . . . . 72.439999999999998 113.509 173.668 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -79.8 -14.45 58.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 120.363 1.438 . . . . 73.439999999999998 112.508 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.9 168.28 12.53 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.739 1.616 . . . . 64.010000000000005 109.557 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -96.1 -172.84 2.65 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.293 1.837 . . . . 65.010000000000005 109.952 165.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.87 -67.56 0.24 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 127.313 2.245 . . . . 63.240000000000002 111.386 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -61.84 -36.76 82.14 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.198 0.599 . . . . 72.030000000000001 110.811 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.567 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -50.46 -74.7 0.26 Allowed Glycine 0 C--N 1.338 0.673 0 C-N-CA 124.98 1.276 . . . . 62.43 110.517 172.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.24 -44.02 92.36 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.802 1.241 . . . . 70.239999999999995 111.938 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -61.05 -37.25 81.97 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.099 0.959 . . . . 71.129999999999995 110.209 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.25 81.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.83 0.741 . . . . 64.329999999999998 111.175 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 50' ' ' GLY . 3.2 t -59.02 -23.31 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 CA-C-N 118.791 0.723 . . . . 73.25 111.089 178.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -74.81 -46.5 36.36 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 120.392 -1.442 . . . . 63.340000000000003 110.298 174.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.48 60.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.911 0.884 . . . . 74.120000000000005 111.549 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.97 -25.97 24.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.746 0.308 . . . . 70.150000000000006 111.748 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -66.54 -30.3 70.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.836 0.854 . . . . 73.209999999999994 112.295 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -78.03 -25.65 47.97 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.098 -1.001 . . . . 70.420000000000002 111.524 167.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.18 45.22 0.73 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.904 1.282 . . . . 45.340000000000003 111.437 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.5 m -160.84 178.63 9.23 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 71.230000000000004 110.663 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.8 66.72 1.34 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 129.69 3.196 . . . . 53.520000000000003 106.579 -146.941 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.18 7.22 1.04 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.31 1.844 . . . . 74.329999999999998 112.861 -167.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 t -68.63 -6.17 24.27 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 128.348 2.659 . . . . 62.299999999999997 111.58 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -131.32 38.11 3.65 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.276 1.03 . . . . 71.420000000000002 109.984 169.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.56 123.21 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 121.511 0.672 . . . . 61.399999999999999 110.042 166.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -80.27 -60.96 2.13 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.141 -0.936 . . . . 74.209999999999994 108.906 168.623 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -80.21 102.94 9.75 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.975 -0.75 . . . . 62.310000000000002 108.975 -171.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -73.89 -28.85 61.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.328 -0.851 . . . . 74.409999999999997 111.142 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.5 m -66.36 -55.82 14.04 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 124.172 0.989 . . . . 74.400000000000006 110.503 -173.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.99 -35.73 77.59 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.726 1.21 . . . . 64.010000000000005 110.17 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -63.89 -48.35 76.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.204 0.526 . . . . 75.329999999999998 110.611 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.04 -48.94 79.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.63 0.772 . . . . 73.040000000000006 110.213 -177.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 3.6 m -55.12 -34.71 63.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.285 1.434 . . . . 74.019999999999996 112.307 170.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -60.46 -48.33 86.71 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.145 0.879 . . . . 45.409999999999997 111.064 176.804 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.6 t -61.48 -43.93 97.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 117.548 0.674 . . . . 71.209999999999994 109.324 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 31.2 mtt -53.76 -45.51 70.64 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 121.095 -1.003 . . . . 72.150000000000006 110.19 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -67.66 -29.51 68.82 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.035 -0.983 . . . . 64.109999999999999 112.722 -168.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 15.1 t -72.8 -49.36 31.07 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.351 1.432 . . . . 54.530000000000001 108.514 169.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -61.38 -33.53 73.83 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.846 -1.159 . . . . 72.219999999999999 113.774 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 -7.16 59.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.341 1.056 . . . . 64.430000000000007 112.368 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 C--O 1.239 0.533 0 C-N-CA 125.458 1.503 . . . . 72.349999999999994 109.303 177.397 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.221 0 N-CA-C 109.981 -1.248 . . . . 73.420000000000002 109.981 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 t -140.83 -154.55 0.52 Allowed 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.118 2.567 . . . . 64.439999999999998 107.544 -164.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -59.25 -26.37 64.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.161 0.584 . . . . 72.010000000000005 111.978 177.404 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.73 -37.21 67.82 Favored 'General case' 0 C--O 1.227 -0.097 0 CA-C-N 118.539 0.609 . . . . 72.030000000000001 110.009 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.461 ' CE2' HD11 ' A' ' 9' ' ' LEU . 41.5 t80 -49.39 -57.95 6.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.1 1.36 . . . . 51.200000000000003 112.643 -166.237 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.447 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 tp60 -64.28 -35.91 82.39 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 118.821 0.737 . . . . 63.009999999999998 112.03 -177.101 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -38.03 77.11 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.467 -0.568 . . . . 62.100000000000001 109.467 -178.454 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.69 -43.13 99.59 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.6 1.16 . . . . 63.200000000000003 109.73 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.461 HD11 ' CE2' ' A' ' 5' ' ' PHE . 59.5 mt -62.35 -16.33 53.76 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.596 -0.69 . . . . 35.149999999999999 112.583 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -104.6 -6.81 20.16 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.242 1.417 . . . . 63.140000000000001 112.171 176.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.02 13.6 2.66 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.447 1.899 . . . . 72.239999999999995 112.693 -168.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.84 4.36 58.98 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.307 1.432 . . . . 44.420000000000002 112.43 -171.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -102.81 158.0 32.62 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 118.727 1.264 . . . . 74.409999999999997 110.55 -162.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.01 -164.42 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.733 1 C-N-CA 126.304 4.67 . . . . 74.420000000000002 112.916 172.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.77 -54.98 4.19 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 120.379 -1.451 . . . . 74.099999999999994 109.599 161.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -50.42 -48.98 55.98 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.412 1.085 . . . . 74.510000000000005 113.818 -164.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.81 -46.9 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 125.175 1.39 . . . . 51.439999999999998 107.696 -173.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.14 -38.3 68.04 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.476 0.58 . . . . 62.219999999999999 111.313 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.73 -16.78 62.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.09 1.145 . . . . 75.540000000000006 114.09 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.5 2.25 16.24 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.873 1.215 . . . . 74.200000000000003 113.346 170.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -103.55 -34.23 8.74 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.7 1.2 . . . . 74.0 111.058 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.32 -40.71 74.84 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.272 0.487 . . . . 75.450000000000003 110.997 176.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.62 -44.7 9.12 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 128.908 2.883 . . . . 74.349999999999994 112.357 174.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -66.8 -19.8 26.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 74.319999999999993 110.23 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -100.37 -13.19 18.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.428 1.091 . . . . 75.25 112.637 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.5 t -89.06 -30.14 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.328 1.051 . . . . 75.340000000000003 111.165 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -85.01 10.76 11.02 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.115 -0.991 . . . . 75.329999999999998 112.973 -167.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.62 24.8 76.07 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.177 0.894 . . . . 74.109999999999999 113.815 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.0 mt -79.7 -83.75 0.1 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.229 2.212 . . . . 75.310000000000002 107.032 168.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.63 165.99 15.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 123.685 0.794 . . . . 54.509999999999998 112.931 -170.658 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.89 155.01 24.32 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.145 1.378 . . . . 64.019999999999996 109.436 164.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -76.1 -12.97 60.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.312 -0.851 . . . . 72.340000000000003 113.172 -175.376 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.1 m -124.91 36.15 4.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.169 1.788 . . . . 75.140000000000001 110.364 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -81.57 15.04 2.25 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 120.981 -1.075 . . . . 75.150000000000006 112.88 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -113.25 177.17 4.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.276 -1.515 . . . . 72.409999999999997 111.077 -163.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -112.81 160.4 18.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.46 1.104 . . . . 75.209999999999994 109.232 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.3 -45.23 72.52 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.277 1.031 . . . . 74.109999999999999 109.428 173.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtt85 -58.87 -25.96 63.81 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.939 0.896 . . . . 73.310000000000002 111.685 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.93 -45.09 29.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.894 0.77 . . . . 72.040000000000006 109.557 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.1 mm -58.47 -40.39 78.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.953 0.901 . . . . 55.229999999999997 109.394 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.73 -38.64 91.3 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.632 0.651 . . . . 72.030000000000001 110.188 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.14 -33.45 65.51 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.59 1.156 . . . . 51.219999999999999 111.536 -173.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.16 -46.09 79.42 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.179 0.899 . . . . 74.200000000000003 112.791 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -22.77 64.41 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.842 0.457 . . . . 64.400000000000006 111.824 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -75.62 -12.35 60.19 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 113.136 0.791 . . . . 72.040000000000006 113.136 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -88.81 164.52 15.18 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 119.614 1.097 . . . . 74.0 109.703 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -101.73 -175.84 2.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 125.347 1.459 . . . . 75.439999999999998 109.42 169.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -46.25 -58.58 3.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.527 1.531 . . . . 72.209999999999994 112.633 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.64 -46.15 83.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 108.186 -1.042 . . . . 73.219999999999999 108.186 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.83 -52.38 53.54 Favored Glycine 0 C--N 1.341 0.843 0 N-CA-C 111.3 -0.72 . . . . 62.229999999999997 111.3 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.97 91.83 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.557 0.743 . . . . 43.299999999999997 110.908 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.0 mt -61.74 -40.12 93.96 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.46 0.573 . . . . 75.340000000000003 111.186 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -65.3 -41.33 94.21 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.148 0.431 . . . . 74.099999999999994 111.419 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.44 -41.81 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.594 0.758 . . . . 63.130000000000003 109.681 175.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.77 -41.9 64.55 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.185 0.594 . . . . 71.129999999999995 110.452 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -54.9 -52.15 63.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.68 -0.859 . . . . 53.219999999999999 108.68 175.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -68.11 -34.13 75.81 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 119.239 -0.984 . . . . 62.43 110.26 -172.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -65.35 -53.84 37.74 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.856 0.462 . . . . 63.420000000000002 110.188 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.29 -41.8 76.5 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.003 0.819 . . . . 75.209999999999994 110.002 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.37 16.22 6.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.72 0.637 . . . . 72.439999999999998 112.72 -175.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.18 165.82 11.52 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.248 -1.532 . . . . 75.209999999999994 112.563 -179.407 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -88.61 93.21 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.587 -1.642 . . . . 63.549999999999997 110.333 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -87.83 53.62 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.838 1.255 . . . . 75.430000000000007 110.166 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 p -61.94 83.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.729 2.412 . . . . 75.430000000000007 112.279 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.3 m80 51.46 33.55 10.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.365 1.466 . . . . 72.319999999999993 112.38 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.449 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -52.16 111.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 127.111 2.164 . . . . 63.420000000000002 110.55 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -56.68 -55.17 37.44 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.724 -0.61 . . . . 74.150000000000006 112.576 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -114.05 84.3 2.01 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.184 1.794 . . . . 72.150000000000006 109.292 -167.062 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HD3' HG13 ' A' ' 66' ' ' VAL . 41.6 mmtm -56.35 -26.83 53.97 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.676 1.191 . . . . 75.25 113.503 -172.387 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.05 -50.07 57.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 128.32 2.648 . . . . 54.520000000000003 109.262 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.8 -38.41 90.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.8 1.24 . . . . 72.040000000000006 110.405 -176.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.8 -47.86 83.22 Favored 'General case' 0 C--O 1.23 0.073 0 N-CA-C 109.153 -0.684 . . . . 73.420000000000002 109.153 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.3 tp -57.79 -52.59 64.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.336 -0.616 . . . . 63.450000000000003 109.336 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.76 -40.32 40.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.904 0.882 . . . . 73.239999999999995 111.197 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -44.64 94.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.826 0.727 . . . . 54.350000000000001 111.808 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.3 t -65.03 -43.03 96.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 122.087 -0.655 . . . . 63.340000000000003 109.799 176.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mtt -57.79 -40.25 79.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 120.799 -1.188 . . . . 62.420000000000002 111.323 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -51.82 -59.6 4.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.256 -0.878 . . . . 72.430000000000007 109.789 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -62.2 -34.49 76.56 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.898 0.772 . . . . 75.239999999999995 111.553 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.422 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 11.5 m-85 -68.06 -37.65 81.53 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 120.603 -1.311 . . . . 75.209999999999994 113.1 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -65.86 -45.9 80.42 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.867 0.758 . . . . 75.109999999999999 109.229 166.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 . . . . . 0 N--CA 1.446 -0.66 0 C-N-CA 124.484 1.114 . . . . 53.310000000000002 110.75 -161.868 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.462 ' HA2' ' OD1' ' A' ' 22' ' ' ASP . . . . . . . . 0 N--CA 1.467 0.753 0 N-CA-C 110.345 -1.102 . . . . 74.030000000000001 110.345 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 t -75.35 -170.21 1.16 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.125 0.97 . . . . 61.109999999999999 109.031 166.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -35.74 78.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.119 1.368 . . . . 53.240000000000002 111.823 167.898 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -58.87 -26.95 64.72 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.065 0.946 . . . . 63.219999999999999 112.811 -169.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -45.86 -41.37 11.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.492 1.917 . . . . 73.0 112.575 175.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -70.12 -37.42 75.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.869 -0.586 . . . . 71.319999999999993 111.847 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -39.5 92.73 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.977 0.808 . . . . 42.100000000000001 109.005 171.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 40.2 mt -59.57 -48.15 82.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.751 0.705 . . . . 63.049999999999997 111.66 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 23.5 mt -51.74 -38.96 57.56 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 123.95 0.9 . . . . 74.0 110.854 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -91.92 -6.96 50.46 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.092 0.557 . . . . 64.439999999999998 112.026 -174.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.86 2.17 50.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 120.411 -1.431 . . . . 75.329999999999998 110.928 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.79 -22.75 8.05 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 124.358 0.98 . . . . 32.119999999999997 112.013 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.15 144.82 67.88 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 117.675 0.737 . . . . 65.409999999999997 110.936 -159.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.47 156.23 61.71 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 C-N-CA 121.708 1.606 . . . . 74.019999999999996 109.361 164.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -59.4 -39.97 85.13 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 124.192 0.997 . . . . 70.010000000000005 108.83 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -56.11 -45.87 79.33 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 112.193 0.442 . . . . 74.129999999999995 112.193 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.69 -50.38 50.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 108.254 -1.017 . . . . 72.150000000000006 108.254 176.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.92 -42.71 65.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.466 0.706 . . . . 61.149999999999999 111.7 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -59.24 -55.6 32.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 119.127 0.876 . . . . 62.420000000000002 110.935 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.14 -30.51 69.67 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 118.593 -0.718 . . . . 71.109999999999999 111.166 -175.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.4 tp -76.39 -36.91 57.84 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.505 1.122 . . . . 72.040000000000006 110.609 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.462 ' OD1' ' HA2' ' A' ' 1' ' ' GLY . 1.1 t70 -55.5 -39.57 70.64 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.749 0.82 . . . . 64.25 110.755 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -29.63 69.41 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.783 1.633 . . . . 74.040000000000006 112.299 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 30' ' ' VAL . 2.4 mt -65.33 -33.07 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 107.662 -1.236 . . . . 72.349999999999994 107.662 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 11.0 m-85 -90.48 7.82 36.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.382 1.873 . . . . 75.239999999999995 112.951 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -99.15 -38.01 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 O-C-N 121.186 -0.947 . . . . 55.149999999999999 109.444 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.34 -17.45 59.4 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.25 0.833 . . . . 72.109999999999999 113.25 -165.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.4 13.18 52.58 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.413 0.551 . . . . 44.25 111.819 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.9 mt -78.06 -55.29 5.4 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.709 -0.848 . . . . 71.450000000000003 108.709 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.439 HG12 ' HB3' ' A' ' 69' ' ' LYS . 21.3 m -140.16 156.54 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.42 0.688 . . . . 74.329999999999998 109.873 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.17 158.66 26.25 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.236 -0.653 . . . . 74.120000000000005 109.236 164.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.439 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 19.2 p80 -62.26 -24.62 67.37 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.786 -0.571 . . . . 73.120000000000005 112.14 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.6 t -107.7 15.74 24.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.173 0.989 . . . . 75.010000000000005 111.793 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.38 -23.88 64.72 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.591 -1.318 . . . . 73.319999999999993 110.989 171.827 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.18 173.95 9.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.015 1.726 . . . . 73.109999999999999 110.599 -174.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.32 175.37 9.0 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.205 1.002 . . . . 73.349999999999994 108.87 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -44.83 -45.14 9.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.443 2.297 . . . . 73.109999999999999 114.589 -171.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -60.75 -21.85 63.43 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.958 0.799 . . . . 62.020000000000003 112.063 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -58.73 4.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.218 1.007 . . . . 40.109999999999999 109.993 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.479 HD12 ' H ' ' A' ' 40' ' ' ILE . 4.4 mp -56.31 -44.89 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.42 1.088 . . . . 62.149999999999999 110.924 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -55.45 -48.64 74.17 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.697 1.199 . . . . 73.319999999999993 110.987 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.42 86.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 118.408 -0.806 . . . . 72.329999999999998 111.101 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -52.95 -37.59 61.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.767 -0.635 . . . . 74.340000000000003 111.338 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -29.48 67.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.211 0.819 . . . . 72.049999999999997 113.211 174.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -66.99 -21.4 65.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 119.72 1.146 . . . . 71.239999999999995 111.366 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -88.27 143.58 26.94 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.323 1.049 . . . . 73.030000000000001 110.928 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -69.04 178.52 2.21 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.734 2.013 . . . . 64.019999999999996 111.292 163.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -51.14 -65.28 0.58 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.797 2.039 . . . . 43.520000000000003 110.939 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -37.67 76.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.723 0.809 . . . . 73.129999999999995 110.603 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.74 -37.05 66.84 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 111.431 -0.667 . . . . 33.329999999999998 111.431 -175.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.52 91.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.587 0.693 . . . . 71.120000000000005 109.496 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 mt -56.41 -37.86 70.76 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.949 -0.47 . . . . 72.140000000000001 111.038 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.53 81.47 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.291 0.496 . . . . 72.349999999999994 112.271 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 37.4 t -51.45 -38.31 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.801 0.728 . . . . 75.219999999999999 110.277 173.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.1 mt -73.2 -53.54 10.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.331 0.653 . . . . 61.310000000000002 109.923 -176.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.1 -43.18 73.79 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 124.001 0.813 . . . . 64.25 110.106 -176.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -69.11 -31.13 69.62 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 123.036 0.21 . . . . 63.43 110.957 -174.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -73.3 -49.46 27.38 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.148 0.979 . . . . 75.319999999999993 111.461 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -60.71 -38.76 86.15 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.876 1.216 . . . . 51.210000000000001 109.733 175.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.31 5.36 20.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.137 0.791 . . . . 74.329999999999998 113.137 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.6 p -74.44 170.65 15.24 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 119.929 1.24 . . . . 34.43 111.224 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -96.86 98.73 10.35 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.955 -1.128 . . . . 42.229999999999997 107.955 173.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.1 mt -98.99 25.39 6.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.482 1.113 . . . . 75.340000000000003 109.848 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 t -67.07 -38.86 86.51 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.26 -0.9 . . . . 64.439999999999998 111.16 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -130.97 23.65 4.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.046 0.938 . . . . 72.120000000000005 112.396 -170.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.45 165.57 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.393 1.077 . . . . 72.120000000000005 110.016 165.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -122.32 -85.68 0.65 Allowed 'General case' 0 C--O 1.234 0.256 0 N-CA-C 106.577 -1.638 . . . . 73.340000000000003 106.577 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.58 116.88 14.69 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.889 -1.152 . . . . 75.430000000000007 107.889 176.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB3' HG12 ' A' ' 30' ' ' VAL . 40.7 mmtm -64.15 -35.92 82.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.621 -0.674 . . . . 63.039999999999999 111.865 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.11 -52.51 65.22 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 126.193 1.797 . . . . 74.030000000000001 108.095 -176.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.54 -25.01 67.82 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.357 -0.838 . . . . 53.119999999999997 112.768 -175.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -74.85 -52.88 10.2 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.715 -0.846 . . . . 62.350000000000001 108.715 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.488 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.7 OUTLIER -61.28 -52.99 62.4 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.49 1.138 . . . . 75.040000000000006 109.109 -173.476 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.0 t -62.96 -20.75 65.55 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.407 -1.27 . . . . 72.340000000000003 110.741 -176.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.94 -53.44 5.79 Favored Glycine 0 C--N 1.34 0.787 0 CA-C-O 117.408 -1.773 . . . . 73.150000000000006 110.878 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 53.7 t -47.72 -50.58 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.148 1.474 . . . . 34.399999999999999 109.327 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.488 ' CE ' HD11 ' A' ' 73' ' ' LEU . 6.6 mtt -53.46 -50.98 64.15 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 119.6 -0.238 . . . . 62.329999999999998 111.007 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.548 ' HA ' HH11 ' A' ' 81' ' ' ARG . 3.5 ttmt -59.67 -47.44 85.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.612 -0.709 . . . . 74.450000000000003 110.621 -177.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.1 m -60.2 -38.58 83.73 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.134 -0.936 . . . . 53.43 111.064 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.89 -58.18 9.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.871 1.214 . . . . 71.219999999999999 111.1 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.548 HH11 ' HA ' ' A' ' 78' ' ' LYS . 6.2 ptp85 -57.88 -35.41 70.94 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 118.033 -0.984 . . . . 62.350000000000001 110.974 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 . . . . . 0 CA--C 1.548 0.885 0 C-N-CA 126.662 1.985 . . . . 71.349999999999994 114.381 -172.514 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.372 0 N-CA-C 109.74 -1.344 . . . . 50.210000000000001 109.74 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 t -127.36 -177.29 4.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.288 1.994 . . . . 70.140000000000001 111.196 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.48 -20.14 64.58 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 113.555 -1.657 . . . . 62.520000000000003 112.794 167.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -74.43 -27.64 60.7 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.591 1.087 . . . . 64.340000000000003 111.05 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -44.95 -53.46 7.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.324 1.45 . . . . 74.099999999999994 111.913 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -64.32 -37.8 88.79 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.97 0.508 . . . . 74.120000000000005 112.204 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 m -64.19 -48.78 74.61 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 108.895 -0.78 . . . . 53.130000000000003 108.895 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.0 mp -58.87 -42.71 90.1 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 124.094 0.958 . . . . 74.439999999999998 110.846 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.8 mt -56.59 -27.26 57.59 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.707 0.803 . . . . 74.430000000000007 111.034 177.095 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -101.05 -3.2 29.78 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.002 0.819 . . . . 54.310000000000002 112.764 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -89.5 10.31 23.29 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 120.522 -1.361 . . . . 74.519999999999996 112.679 -169.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.85 3.43 42.63 Favored Glycine 0 CA--C 1.527 0.804 0 C-N-CA 125.331 1.443 . . . . 70.209999999999994 113.072 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.3 mt -111.68 157.73 38.54 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 118.785 1.293 . . . . 70.219999999999999 111.201 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.43 167.89 18.77 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.169 2.579 . . . . 65.400000000000006 111.657 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -66.01 -47.42 74.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 124.615 1.166 . . . . 50.130000000000003 109.177 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -43.27 83.17 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.525 -0.47 . . . . 74.340000000000003 111.155 -172.503 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.77 -53.84 39.57 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.566 -1.272 . . . . 71.099999999999994 107.566 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.22 -51.34 45.05 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.334 1.054 . . . . 54.200000000000003 111.628 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -55.18 -45.37 75.79 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.805 0.73 . . . . 73.409999999999997 111.536 -178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -38.85 51.72 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 118.449 -0.786 . . . . 72.0 111.031 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.19 -39.24 71.93 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 126.451 1.9 . . . . 70.319999999999993 111.099 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.01 -42.26 79.99 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.981 1.313 . . . . 73.140000000000001 111.075 -177.345 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -64.93 -22.66 67.04 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.319 1.448 . . . . 74.120000000000005 113.03 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.443 HG23 ' HE3' ' A' ' 59' ' ' LYS . 9.4 mt -70.76 -22.25 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 O-C-N 121.068 -1.02 . . . . 73.230000000000004 108.571 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.77 23.55 11.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.683 1.993 . . . . 70.5 112.126 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 91.8 t -115.45 -38.92 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.269 1.028 . . . . 72.5 110.419 174.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.28 5.55 14.4 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.511 -0.743 . . . . 71.099999999999994 112.945 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 -8.84 76.93 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 127.329 2.395 . . . . 71.510000000000005 113.539 177.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.3 mt -61.96 -60.84 3.03 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 126.419 1.887 . . . . 72.129999999999995 110.084 -165.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 m -130.34 179.16 4.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.257 -0.883 . . . . 72.010000000000005 109.88 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -122.71 164.69 17.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.465 1.106 . . . . 73.219999999999999 109.13 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -59.7 -12.09 6.35 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.08 1.141 . . . . 74.430000000000007 114.08 -173.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.63 23.99 4.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.01 1.324 . . . . 65.140000000000001 112.564 -177.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -73.84 30.66 0.08 Allowed 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.591 -1.318 . . . . 74.310000000000002 111.382 169.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.6 mt -125.18 -177.48 3.88 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.079 2.152 . . . . 44.409999999999997 110.353 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -137.06 163.03 31.73 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.04 -1.467 . . . . 64.219999999999999 107.04 172.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -55.93 -37.99 69.68 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.647 1.579 . . . . 74.400000000000006 111.51 -175.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.0 ptt180 -55.53 -36.69 67.02 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.659 0.985 . . . . 45.530000000000001 113.659 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.07 -40.5 38.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.413 -0.588 . . . . 72.409999999999997 109.413 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.3 mm -60.78 -44.1 96.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 122.995 0.518 . . . . 72.0 110.268 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.46 -50.92 65.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.466 0.706 . . . . 65.310000000000002 109.819 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.24 71.15 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 117.644 -1.17 . . . . 45.140000000000001 112.68 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.85 -46.39 90.76 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.973 1.261 . . . . 51.140000000000001 110.066 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -40.94 98.88 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 118.022 0.374 . . . . 71.310000000000002 110.389 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -76.73 43.51 0.34 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.485 1.114 . . . . 62.399999999999999 111.999 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -138.41 149.59 45.66 Favored 'General case' 0 C--O 1.233 0.193 0 O-C-N 121.087 -1.008 . . . . 72.420000000000002 108.317 162.677 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -68.62 163.66 23.21 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.331 1.452 . . . . 73.120000000000005 110.358 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -47.83 -70.99 0.08 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 127.455 2.302 . . . . 63.43 110.864 -179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -70.52 -23.28 62.61 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.28 -0.263 . . . . 74.120000000000005 111.24 -172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.85 -60.74 5.83 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 109.938 -1.265 . . . . 70.430000000000007 109.938 176.305 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -47.63 -40.94 20.93 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.582 1.953 . . . . 53.32 111.884 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -46.86 83.29 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.668 1.187 . . . . 72.109999999999999 111.576 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.71 -45.84 81.6 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.036 0.446 . . . . 73.319999999999993 109.837 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.74 -37.89 62.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 123.283 0.633 . . . . 74.439999999999998 110.975 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.56 -45.37 75.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.192 -0.942 . . . . 73.400000000000006 109.938 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -56.04 -49.73 72.91 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.98 -0.748 . . . . 70.0 108.98 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -65.41 -28.2 69.08 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.14 0.427 . . . . 74.310000000000002 111.878 -174.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.86 -33.89 51.95 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.764 0.826 . . . . 62.409999999999997 112.943 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HE3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -63.04 -37.84 88.81 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.82 -1.175 . . . . 72.0 110.005 168.902 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -83.76 52.63 2.32 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.903 2.481 . . . . 74.409999999999997 109.995 -175.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.62 170.97 17.88 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.42 1.088 . . . . 71.299999999999997 110.457 170.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.46 77.4 1.09 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 125.746 1.619 . . . . 73.209999999999994 108.017 -169.561 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.17 49.53 0.69 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.161 1.384 . . . . 74.409999999999997 110.977 -175.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -111.12 -21.51 11.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.201 1.8 . . . . 72.219999999999999 112.205 -175.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -130.64 16.58 5.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.239 1.016 . . . . 71.340000000000003 111.776 176.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.5 t -90.52 104.85 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 107.586 -1.264 . . . . 63.409999999999997 107.586 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -58.43 -35.42 72.07 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.709 0.633 . . . . 65.230000000000004 112.709 175.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.5 p30 -129.07 78.74 1.87 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.988 0.899 . . . . 42.299999999999997 111.472 -170.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 44.0 mmtt -48.26 -40.68 25.46 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.516 1.526 . . . . 72.409999999999997 110.445 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.6 p -55.22 -61.01 2.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.443 2.697 . . . . 72.230000000000004 111.364 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.7 -29.81 70.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 119.111 -0.471 . . . . 72.099999999999994 111.278 -177.566 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -63.07 -52.23 63.57 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.466 -0.939 . . . . 72.120000000000005 108.466 173.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.84 -47.06 81.2 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.047 1.339 . . . . 74.129999999999995 109.836 178.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -27.13 68.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.012 0.925 . . . . 72.420000000000002 111.907 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.76 -54.84 6.96 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 109.603 -1.399 . . . . 71.140000000000001 109.603 176.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 89.0 t -52.36 -48.14 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.867 0.867 . . . . 74.140000000000001 109.562 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 36.2 mtt -50.25 -52.27 37.57 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.908 -1.12 . . . . 63.020000000000003 111.237 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.28 89.34 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 118.01 -0.995 . . . . 61.210000000000001 111.184 -171.532 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 t -67.74 -28.29 67.51 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.954 1.252 . . . . 74.319999999999993 111.178 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -71.32 -46.27 61.06 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.57 1.532 . . . . 74.310000000000002 110.612 169.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.78 24.71 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.419 -1.426 . . . . 73.129999999999995 113.068 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.466 0 C-N-CA 127.015 2.126 . . . . 73.310000000000002 111.753 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.53 0 N-CA-C 110.574 -1.01 . . . . 64.230000000000004 110.574 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -69.18 179.73 1.84 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.382 0.61 . . . . 64.120000000000005 109.536 157.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -49.48 -35.9 21.21 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.356 1.463 . . . . 64.450000000000003 113.002 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.73 -34.6 74.65 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.184 0.993 . . . . 75.450000000000003 109.771 -166.344 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -44.77 -54.57 6.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.004 1.322 . . . . 61.119999999999997 110.486 176.34 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -66.56 -31.62 72.45 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.974 -1.013 . . . . 63.450000000000003 111.848 -176.761 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -60.08 -46.73 88.62 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.74 1.155 . . . . 75.25 109.63 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.45 -40.48 95.81 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.206 -0.934 . . . . 62.25 110.963 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.41 -20.09 65.25 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.796 0.725 . . . . 72.519999999999996 112.139 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -86.87 -36.78 18.24 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.366 1.066 . . . . 71.239999999999995 109.081 175.628 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.06 64.28 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.599 1.96 . . . . 72.340000000000003 113.38 -166.757 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.87 17.0 2.61 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 119.322 -0.71 . . . . 55.130000000000003 113.176 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.3 mt -112.8 148.08 38.55 Favored Pre-proline 0 C--O 1.239 0.509 0 CA-C-N 118.133 0.966 . . . . 60.130000000000003 111.96 -156.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.07 154.19 70.89 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.793 2.328 . . . . 74.409999999999997 109.112 174.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.0 -40.88 78.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 108.024 -1.102 . . . . 62.549999999999997 108.024 -168.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -56.53 18.31 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 123.741 0.65 . . . . 52.049999999999997 109.862 -175.438 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.7 t -58.36 -45.37 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 N-CA-C 108.166 -1.05 . . . . 74.540000000000006 108.166 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.24 80.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.367 0.877 . . . . 73.209999999999994 113.367 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -55.5 -35.74 65.91 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.6 0.76 . . . . 64.340000000000003 111.1 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -91.84 -15.89 27.54 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.232 1.413 . . . . 74.439999999999998 111.544 -173.522 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.581 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -79.45 -38.54 34.4 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 124.787 1.235 . . . . 63.530000000000001 111.799 171.631 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -52.68 -48.2 66.68 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 123.949 0.9 . . . . 61.43 109.628 -171.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -64.91 -5.25 5.67 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.082 2.153 . . . . 75.109999999999999 115.092 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.1 mt -90.82 -10.72 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 124.386 1.074 . . . . 75.409999999999997 109.544 173.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.581 ' HE2' HD23 ' A' ' 21' ' ' LEU . 67.5 m-85 -109.93 6.29 23.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.218 1.407 . . . . 74.140000000000001 113.95 -178.06 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -120.14 -5.82 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.779 1.232 . . . . 73.329999999999998 111.819 -173.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.68 6.22 23.54 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.269 -1.519 . . . . 74.109999999999999 112.311 -172.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.19 12.54 84.05 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.181 0.895 . . . . 31.23 113.614 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.69 -65.19 0.89 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.608 1.963 . . . . 73.150000000000006 109.628 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -129.84 156.98 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 N-CA-C 113.765 1.024 . . . . 75.439999999999998 113.765 171.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.97 149.86 39.21 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 125.605 1.562 . . . . 70.549999999999997 109.945 161.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -55.92 -47.96 76.57 Favored 'General case' 0 C--O 1.228 -0.062 0 C-N-CA 123.634 0.773 . . . . 61.109999999999999 110.962 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.1 t -83.77 3.2 34.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.346 0.498 . . . . 70.439999999999998 112.346 -172.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -67.48 -28.49 67.9 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.763 -1.211 . . . . 72.150000000000006 111.911 -174.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.67 155.24 40.82 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.311 -0.625 . . . . 74.519999999999996 109.311 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -111.61 167.02 10.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.388 -0.968 . . . . 74.099999999999994 108.388 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.16 -37.42 64.43 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.041 0.536 . . . . 72.340000000000003 112.313 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -54.84 -39.52 68.66 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.24 0.473 . . . . 73.0 111.828 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.02 -39.28 66.12 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.955 -0.545 . . . . 61.43 110.955 177.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.66 -46.05 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.972 0.805 . . . . 63.43 108.99 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.39 -55.73 30.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.854 1.662 . . . . 71.030000000000001 110.298 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.65 76.52 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.852 0.461 . . . . 61.210000000000001 111.176 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.49 -52.49 65.18 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.226 1.011 . . . . 73.239999999999995 110.642 173.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.53 -18.95 3.19 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 117.575 -1.202 . . . . 63.32 113.6 171.651 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -86.37 -7.13 58.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 121.896 2.134 . . . . 60.210000000000001 114.877 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -90.15 -177.34 5.12 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.547 1.521 . . . . 74.109999999999999 110.948 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -105.67 173.52 6.28 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 124.971 1.308 . . . . 62.420000000000002 108.962 162.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -53.85 -69.87 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 126.065 1.746 . . . . 75.420000000000002 111.144 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -68.47 -10.81 57.91 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.86 1.664 . . . . 75.299999999999997 111.581 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -74.24 -72.98 0.96 Allowed Glycine 0 C--N 1.339 0.719 0 N-CA-C 108.504 -1.838 . . . . 62.219999999999999 108.504 172.293 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.83 -36.95 49.95 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.142 0.977 . . . . 74.230000000000004 112.343 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.73 -44.97 94.82 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.909 0.884 . . . . 64.299999999999997 111.137 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.65 92.04 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.822 0.737 . . . . 63.020000000000003 111.698 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLY . 57.3 t -56.62 -30.97 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.978 1.311 . . . . 74.209999999999994 110.503 -178.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.6 mt -68.19 -45.91 72.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.426 1.49 . . . . 75.510000000000005 110.791 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -54.37 -42.62 70.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.247 -0.649 . . . . 75.310000000000002 109.247 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -76.91 0.88 19.31 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.738 1.014 . . . . 63.119999999999997 113.738 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -110.39 -41.16 4.44 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.786 1.635 . . . . 73.299999999999997 111.402 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -28.47 68.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 120.432 -1.417 . . . . 72.200000000000003 111.029 175.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -82.59 1.75 36.57 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 118.625 -0.702 . . . . 53.310000000000002 112.716 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.5 m -92.45 -176.11 4.21 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 120.341 1.428 . . . . 71.239999999999995 111.105 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.99 79.88 1.93 Allowed 'General case' 0 C--O 1.24 0.566 0 C-N-CA 126.024 1.73 . . . . 62.399999999999999 109.246 -170.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.45 ' H ' HD22 ' A' ' 63' ' ' LEU . 1.0 OUTLIER -86.1 -6.43 59.02 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.038 -1.664 . . . . 72.439999999999998 113.309 -162.813 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.1 -62.3 1.54 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.585 1.954 . . . . 62.539999999999999 111.651 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -86.31 2.04 48.8 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.551 0.74 . . . . 72.140000000000001 112.462 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.95 151.58 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.259 -0.901 . . . . 71.129999999999995 109.504 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -83.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.414 1.886 . . . . 61.130000000000003 108.868 174.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -98.33 117.74 33.41 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 74.439999999999998 107.569 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.3 mmtm -56.6 -39.25 73.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.03 0.832 . . . . 70.310000000000002 110.859 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -47.38 74.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.631 1.172 . . . . 74.299999999999997 110.446 -174.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.29 -23.67 67.09 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.431 -0.507 . . . . 51.420000000000002 111.71 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -64.34 -55.49 20.81 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 107.873 -1.158 . . . . 65.400000000000006 107.873 173.677 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.98 -50.68 63.65 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.24 1.816 . . . . 64.310000000000002 110.559 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.61 -22.01 66.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.113 -0.494 . . . . 74.400000000000006 111.835 -177.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.43 -52.09 42.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.214 -1.154 . . . . 51.509999999999998 110.214 172.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.4 t -55.3 -46.4 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 123.735 0.814 . . . . 74.010000000000005 109.033 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 46.4 mtt -55.37 -41.62 72.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.077 0.769 . . . . 73.420000000000002 113.077 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.29 -46.83 85.37 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.932 0.787 . . . . 60.130000000000003 109.238 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -57.8 -56.14 25.84 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.065 0.546 . . . . 71.0 109.944 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CG ' HG22 ' A' ' 54' ' ' VAL . 22.8 m-85 -55.39 -43.58 75.32 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.976 0.807 . . . . 62.039999999999999 111.527 -178.761 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -3.22 37.17 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.93 -1.106 . . . . 71.420000000000002 113.847 -177.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.242 0 C-N-CA 126.0 1.72 . . . . 72.120000000000005 107.714 171.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.481 ' HA3' ' OD2' ' A' ' 22' ' ' ASP . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 109.691 -1.364 . . . . 73.239999999999995 109.691 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -137.97 -168.55 2.37 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.04 0.536 . . . . 73.120000000000005 110.012 -163.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -57.21 -29.27 63.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.057 0.943 . . . . 74.230000000000004 112.616 -177.11 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -66.86 -37.4 84.37 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 123.424 0.69 . . . . 72.049999999999997 109.3 -165.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -46.35 -59.86 2.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.577 0.751 . . . . 63.25 111.132 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -60.91 -45.93 92.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.976 -0.535 . . . . 73.25 112.228 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -68.34 -26.58 65.68 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.385 0.993 . . . . 70.040000000000006 110.824 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -35.22 77.3 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 119.857 -1.777 . . . . 73.140000000000001 110.339 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.28 -20.39 66.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.529 1.059 . . . . 51.439999999999998 111.536 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.06 -17.83 21.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.408 0.683 . . . . 61.219999999999999 112.361 175.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.61 9.51 1.39 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.227 1.411 . . . . 71.030000000000001 112.448 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.11 17.6 71.6 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.566 1.079 . . . . 33.200000000000003 113.096 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -103.76 156.32 35.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.403 1.081 . . . . 72.319999999999993 110.684 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.16 160.03 46.19 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.051 3.167 . . . . 74.230000000000004 113.062 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -63.88 -45.7 88.19 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.717 0.807 . . . . 74.340000000000003 109.248 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -23.67 65.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.901 -1.12 . . . . 52.119999999999997 112.353 -168.037 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -70.66 -56.94 9.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 N-CA-C 106.726 -1.583 . . . . 62.240000000000002 106.726 168.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.01 -40.21 60.64 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.385 0.993 . . . . 71.040000000000006 113.058 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.52 -15.19 57.21 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.52 1.528 . . . . 71.209999999999994 113.667 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.3 -18.87 12.4 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.651 1.581 . . . . 73.230000000000004 112.108 173.56 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.2 tp -92.42 -29.65 16.17 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 126.15 1.78 . . . . 74.329999999999998 111.581 -173.702 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.481 ' OD2' ' HA3' ' A' ' 1' ' ' GLY . 5.9 t0 -56.97 -43.88 82.09 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 123.495 0.718 . . . . 73.409999999999997 110.416 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -34.25 66.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.902 2.081 . . . . 74.25 113.811 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.482 HD12 ' HE2' ' A' ' 59' ' ' LYS . 11.5 mm -58.85 -20.69 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 123.932 0.893 . . . . 74.329999999999998 109.289 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 32' ' ' HIS . 39.5 m-85 -104.67 9.53 35.12 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.676 1.59 . . . . 74.120000000000005 112.968 177.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -116.21 -32.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.593 1.557 . . . . 75.209999999999994 111.068 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.68 24.22 0.89 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.847 0.859 . . . . 74.349999999999994 111.19 -176.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.01 80.62 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.98 1.753 . . . . 74.030000000000001 113.93 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.697 HD13 ' HE3' ' A' ' 59' ' ' LYS . 2.2 mt -73.78 -63.89 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.873 1.337 . . . . 64.030000000000001 110.527 -168.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.55 158.71 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.392 1.077 . . . . 54.420000000000002 113.465 -169.45 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.15 13.04 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 127.732 2.413 . . . . 54.149999999999999 115.47 -172.187 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 25' ' ' TYR 0.258 6.7 p-80 56.11 -21.77 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.939 2.496 . . . . 71.040000000000006 116.604 -161.452 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 23.9 5.55 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.59 1.556 . . . . 74.010000000000005 111.409 -177.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -70.15 19.13 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.617 1.967 . . . . 64.230000000000004 113.766 -175.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.8 mt -129.22 -171.83 2.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.439 1.496 . . . . 72.420000000000002 110.701 -152.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.91 169.74 17.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 126.969 2.107 . . . . 74.0 107.806 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -47.28 -46.03 24.47 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 126.537 1.935 . . . . 73.5 112.423 -169.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -54.97 -29.32 56.62 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.746 0.647 . . . . 74.200000000000003 112.746 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.63 -47.81 65.67 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 118.828 -0.606 . . . . 74.040000000000006 110.605 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.523 HD12 ' H ' ' A' ' 40' ' ' ILE . 3.6 mp -71.19 -43.46 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 119.024 0.829 . . . . 71.409999999999997 109.707 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -67.87 -48.09 67.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 119.129 -0.462 . . . . 62.119999999999997 110.456 -173.415 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -22.5 64.11 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.014 0.825 . . . . 73.340000000000003 111.985 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.05 -37.5 77.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.575 1.08 . . . . 71.230000000000004 111.847 166.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm -65.82 -25.63 67.31 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.803 0.729 . . . . 70.540000000000006 111.544 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -87.77 21.75 2.52 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.422 -0.799 . . . . 70.209999999999994 111.976 -167.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -125.37 156.93 37.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.924 -1.11 . . . . 54.130000000000003 109.95 175.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -67.94 169.71 9.46 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.702 -0.681 . . . . 65.420000000000002 109.534 155.696 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -50.27 -58.86 4.7 Favored 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 125.727 1.611 . . . . 73.510000000000005 109.603 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -4.04 35.03 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.317 1.047 . . . . 50.340000000000003 112.26 -174.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -86.12 -57.09 2.18 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 109.055 -1.618 . . . . 61.210000000000001 109.055 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.99 89.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.94 1.296 . . . . 73.319999999999993 112.233 -175.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.74 -44.29 93.85 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 119.18 0.9 . . . . 73.340000000000003 110.572 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.65 -43.89 93.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 120.571 -0.451 . . . . 54.43 111.226 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 61.1 t -54.34 -41.11 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.285 -0.884 . . . . 62.5 110.264 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.54 -52.22 58.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.4 -0.593 . . . . 74.299999999999997 109.4 -178.179 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -58.18 -33.67 69.5 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 123.759 0.662 . . . . 75.120000000000005 109.609 -174.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -91.87 -27.77 17.73 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.69 0.677 . . . . 72.530000000000001 111.745 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -62.08 -20.96 64.56 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.469 0.652 . . . . 73.200000000000003 110.971 164.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.697 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -102.57 -19.47 14.84 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 113.594 0.961 . . . . 64.299999999999997 113.594 176.322 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -80.5 59.99 3.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.059 1.744 . . . . 60.509999999999998 107.003 158.598 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.1 m -158.1 163.72 37.35 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.526 1.531 . . . . 71.099999999999994 107.708 170.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -105.92 128.91 54.09 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 105.137 -2.171 . . . . 74.510000000000005 105.137 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.0 mt -116.35 44.83 1.9 Allowed 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.701 2.4 . . . . 75.219999999999999 109.004 -172.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.3 m -59.08 95.58 0.03 OUTLIER 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.726 0.81 . . . . 71.409999999999997 111.395 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 49.14 35.05 6.56 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 128.309 2.643 . . . . 75.439999999999998 113.485 177.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.445 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -60.02 111.53 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.682 -1.229 . . . . 74.109999999999999 107.682 169.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -67.23 -40.12 86.31 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.705 -1.247 . . . . 63.340000000000003 109.762 168.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -78.32 50.45 0.93 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.201 1.4 . . . . 60.109999999999999 112.514 -170.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD3' HG13 ' A' ' 66' ' ' VAL . 35.1 mmtm -52.71 -39.93 62.49 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 120.946 -1.096 . . . . 72.409999999999997 112.196 -177.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.7 p -66.13 -53.35 38.91 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.325 1.05 . . . . 72.530000000000001 110.14 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -38.45 84.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.1 -0.476 . . . . 74.129999999999995 110.723 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -62.58 -49.55 74.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 108.93 -0.767 . . . . 75.209999999999994 108.93 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.68 -50.61 70.46 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.89 0.876 . . . . 73.239999999999995 109.795 -177.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.5 t -64.93 -21.82 66.89 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.106 0.962 . . . . 33.140000000000001 110.943 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.37 -53.46 13.29 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 126.063 1.792 . . . . 71.510000000000005 110.795 169.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -55.81 -47.93 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.736 1.268 . . . . 73.230000000000004 108.652 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 44.7 mtt -48.05 -56.9 6.63 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.95 0.9 . . . . 72.219999999999999 110.839 172.424 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -59.13 -43.53 92.0 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.882 -0.784 . . . . 73.230000000000004 108.882 -175.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -60.99 -35.34 76.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 119.244 -0.408 . . . . 70.319999999999993 111.647 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -65.83 -42.53 90.41 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.558 -1.339 . . . . 72.200000000000003 112.71 175.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -79.35 -15.91 57.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 118.407 -0.806 . . . . 72.140000000000001 113.108 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 . . . . . 0 N--CA 1.45 -0.451 0 C-N-CA 126.535 1.934 . . . . 71.109999999999999 107.327 -174.073 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.445 0 N-CA-C 110.19 -1.164 . . . . 42.25 110.19 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.48 -173.41 2.52 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.743 1.217 . . . . 41.109999999999999 111.684 -169.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -44.18 -45.04 8.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.162 2.185 . . . . 73.140000000000001 110.899 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.73 -34.44 78.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.632 1.173 . . . . 75.310000000000002 110.649 -170.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.62 -50.04 69.05 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.17 0.988 . . . . 63.450000000000003 112.133 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.97 -40.59 91.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.082 -0.485 . . . . 73.519999999999996 111.253 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.3 m -61.65 -45.51 93.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.788 0.435 . . . . 72.420000000000002 110.294 175.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.3 mt -61.4 -43.15 99.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.493 0.717 . . . . 44.310000000000002 111.993 -176.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.4 mt -57.77 -40.33 79.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.587 -0.523 . . . . 63.32 109.587 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -82.09 -20.27 38.5 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.646 0.26 . . . . 72.109999999999999 111.26 -172.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.41 18.91 0.14 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.643 2.777 . . . . 75.209999999999994 111.895 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.413 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 89.18 -0.43 81.52 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 125.157 1.36 . . . . 34.100000000000001 114.115 168.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 90.8 mt -77.08 147.93 77.59 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.863 1.332 . . . . 62.210000000000001 111.107 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.32 156.93 60.54 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.152 1.901 . . . . 64.340000000000003 109.441 165.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.47 -42.93 97.24 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 124.127 0.971 . . . . 71.109999999999999 108.909 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.1 -37.15 74.0 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 118.608 -0.71 . . . . 72.209999999999994 111.602 -174.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.1 t -78.58 -47.27 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.446 1.098 . . . . 73.129999999999995 108.287 -179.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.16 70.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.173 0.589 . . . . 61.210000000000001 111.578 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.41 -55.35 22.33 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.881 1.273 . . . . 71.209999999999994 110.98 178.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -45.25 83.53 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.022 0.529 . . . . 71.439999999999998 110.101 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.09 -36.08 81.2 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.095 0.558 . . . . 71.549999999999997 111.685 -167.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.61 -45.59 73.68 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.486 1.115 . . . . 74.129999999999995 110.521 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.84 -19.75 65.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 114.26 1.208 . . . . 53.420000000000002 114.26 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.413 HG22 HG22 ' A' ' 30' ' ' VAL . 14.3 mt -72.11 -27.91 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 108.746 -0.835 . . . . 71.319999999999993 108.746 177.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.65 -23.12 24.34 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.649 1.18 . . . . 75.129999999999995 111.656 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.9 t -73.14 -33.56 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 123.624 0.77 . . . . 71.430000000000007 111.262 177.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.44 17.59 15.77 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.509 0.929 . . . . 71.530000000000001 113.509 -164.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.21 33.41 78.17 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 123.781 0.705 . . . . 75.450000000000003 114.343 170.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -94.48 -75.03 0.52 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 127.295 2.238 . . . . 74.239999999999995 108.883 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.413 HG22 HG22 ' A' ' 24' ' ' ILE . 17.6 m -123.32 163.66 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.64 1.176 . . . . 74.530000000000001 110.057 -174.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.86 160.73 25.96 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.901 0.481 . . . . 74.140000000000001 110.492 167.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.67 -28.08 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.566 -0.709 . . . . 61.409999999999997 110.169 166.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.2 p -81.69 -1.05 45.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.098 0.959 . . . . 74.340000000000003 112.272 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.47 -13.24 61.39 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.354 -0.841 . . . . 75.319999999999993 112.95 -171.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.35 156.99 21.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.624 1.169 . . . . 55.350000000000001 111.246 -174.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -91.35 163.21 14.29 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.398 1.079 . . . . 42.310000000000002 108.186 164.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -61.87 -28.35 69.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.764 0.426 . . . . 51.350000000000001 110.589 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -62.63 -29.92 70.98 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.795 -1.191 . . . . 74.109999999999999 111.059 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.87 -47.09 49.07 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.644 -0.693 . . . . 33.32 109.824 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.0 mm -57.22 -38.69 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.587 0.63 . . . . 55.310000000000002 110.224 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.44 -54.44 8.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.101 0.56 . . . . 61.130000000000003 110.573 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.2 64.65 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.26 0.467 . . . . 72.540000000000006 112.26 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 mt -63.11 -42.9 99.66 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.757 1.223 . . . . 74.430000000000007 111.714 171.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -70.52 -24.34 62.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.767 1.167 . . . . 63.149999999999999 110.957 173.593 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -76.84 34.6 0.15 Allowed 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.155 -0.966 . . . . 62.43 111.503 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -134.49 151.93 51.46 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.286 1.034 . . . . 71.129999999999995 108.403 165.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -78.86 176.73 9.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.191 0.52 . . . . 64.530000000000001 109.784 161.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -61.3 2.51 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 125.863 1.665 . . . . 73.25 111.32 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -67.07 -24.48 65.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.081 0.552 . . . . 55.030000000000001 111.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.52 -69.64 1.22 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 109.331 -1.508 . . . . 52.43 109.331 170.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.43 -41.27 76.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.26 1.424 . . . . 52.020000000000003 111.503 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.9 mt -62.03 -39.4 92.19 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 118.37 -0.824 . . . . 71.510000000000005 111.501 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.29 84.42 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.572 0.624 . . . . 75.219999999999999 110.012 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 t -55.4 -40.68 58.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.371 0.532 . . . . 73.519999999999996 110.569 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.26 -45.72 69.03 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.623 0.769 . . . . 64.109999999999999 109.794 -176.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -58.49 -51.73 68.64 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.885 0.741 . . . . 73.230000000000004 109.462 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -69.57 -30.68 68.52 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.531 0.605 . . . . 60.109999999999999 111.407 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -67.13 -39.82 86.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.865 1.266 . . . . 74.329999999999998 111.266 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -43.71 78.25 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.493 -0.754 . . . . 60.43 110.083 171.506 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -76.96 46.49 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.497 1.919 . . . . 63.329999999999998 110.212 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.96 -174.77 3.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.923 2.089 . . . . 61.340000000000003 107.686 170.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -120.02 112.27 18.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.628 1.171 . . . . 54.340000000000003 108.565 176.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.0 mt -95.59 30.2 2.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.297 1.439 . . . . 71.420000000000002 110.295 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.95 -69.89 0.34 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.933 -1.136 . . . . 65.439999999999998 107.933 163.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -80.19 39.22 0.44 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.27 1.428 . . . . 73.420000000000002 113.083 -173.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -106.91 165.17 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.128 0.971 . . . . 53.520000000000003 108.83 170.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.68 -70.52 0.33 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.99 1.316 . . . . 72.150000000000006 108.9 170.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -56.99 75.8 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 128.993 2.917 . . . . 75.439999999999998 111.204 159.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -51.24 -32.04 22.89 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.262 -0.899 . . . . 74.120000000000005 111.644 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.8 p -65.47 -56.84 10.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 118.587 0.63 . . . . 64.549999999999997 109.977 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.67 -33.97 68.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.257 0.623 . . . . 73.109999999999999 111.436 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -60.82 -53.08 61.67 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.299 0.571 . . . . 72.230000000000004 109.945 176.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.1 tp -62.46 -42.45 99.47 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-O 121.445 0.641 . . . . 65.219999999999999 110.025 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.42 -37.75 68.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.79 1.636 . . . . 72.510000000000005 110.379 176.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.66 -57.4 17.91 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 124.966 1.27 . . . . 74.420000000000002 110.462 174.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.44 -47.86 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 117.804 0.802 . . . . 40.030000000000001 109.366 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.4 mtt -52.78 -46.74 67.74 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.985 0.914 . . . . 72.239999999999995 112.165 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -57.8 -49.92 75.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 118.796 0.725 . . . . 61.32 109.52 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -43.42 54.7 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.465 0.706 . . . . 62.119999999999997 111.647 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -71.8 -38.12 70.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.166 1.172 . . . . 72.310000000000002 114.166 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -73.66 -21.87 60.14 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.97 1.259 . . . . 74.439999999999998 111.786 172.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -101.03 69.37 1.3 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.399 1.08 . . . . 61.340000000000003 108.609 -177.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 -128.33 68.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.496 1.119 . . . . 63.109999999999999 108.461 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -124.16 123.58 40.61 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 106.725 -1.583 . . . . 74.420000000000002 106.725 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.2 tptp . . . . . 0 C--O 1.25 1.118 0 N-CA-C 108.761 -0.829 . . . . 75.150000000000006 108.761 -170.878 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 109.801 -1.32 . . . . 72.540000000000006 109.801 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t -129.34 -175.05 3.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.518 1.127 . . . . 70.099999999999994 110.453 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.19 -17.6 64.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 126.649 1.98 . . . . 74.310000000000002 113.924 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -67.95 -36.94 80.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.136 0.88 . . . . 65.200000000000003 109.09 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.53 ' CE2' HD11 ' A' ' 9' ' ' LEU . 54.8 t80 -46.51 -53.35 11.46 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 125.897 1.679 . . . . 62.240000000000002 112.577 -177.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.45 -47.26 86.15 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.769 0.428 . . . . 45.200000000000003 111.552 -175.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.7 m -67.93 -35.59 78.69 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.042 -0.355 . . . . 74.120000000000005 110.042 -176.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.7 -34.96 60.43 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.38 -0.825 . . . . 73.340000000000003 112.067 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.53 HD11 ' CE2' ' A' ' 5' ' ' PHE . 17.3 mt -54.54 -36.23 64.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.32 0.648 . . . . 72.430000000000007 110.063 166.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -83.46 -21.07 32.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.669 0.788 . . . . 74.430000000000007 111.705 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 1.51 6.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.519 1.928 . . . . 71.430000000000007 112.236 174.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.47 0.79 46.9 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.683 1.135 . . . . 51.140000000000001 113.28 174.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.7 mt -84.94 144.72 42.19 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 118.241 1.02 . . . . 73.200000000000003 109.636 -169.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.91 156.04 56.62 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.922 1.748 . . . . 52.0 110.285 173.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -59.32 -45.7 90.59 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 124.951 1.3 . . . . 62.109999999999999 108.698 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -39.59 86.95 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.366 0.416 . . . . 74.329999999999998 111.098 -172.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.72 -58.78 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.681 1.592 . . . . 63.329999999999998 107.994 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.47 -44.99 46.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.448 1.099 . . . . 61.420000000000002 112.532 -174.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -58.6 -41.76 86.58 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.458 1.026 . . . . 44.409999999999997 111.467 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.61 -39.55 64.49 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.809 -0.557 . . . . 74.329999999999998 110.739 177.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.9 tp -69.76 -39.64 76.57 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.852 1.261 . . . . 73.319999999999993 110.811 -169.025 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -53.85 -47.1 71.32 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.952 1.301 . . . . 74.109999999999999 110.819 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.76 -24.78 58.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.77 1.628 . . . . 65.549999999999997 113.468 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -75.07 -25.09 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.128 -0.983 . . . . 72.25 109.183 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -89.43 -10.4 46.58 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.885 1.674 . . . . 70.319999999999993 112.706 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.8 t -84.79 -32.84 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 124.406 1.082 . . . . 65.319999999999993 111.975 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.73 13.86 16.97 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.91 0.777 . . . . 73.340000000000003 112.985 -168.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 61.55 31.44 77.68 Favored Glycine 0 CA--C 1.53 1.004 0 O-C-N 121.617 -0.677 . . . . 54.140000000000001 112.4 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.451 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 22.1 mt -83.54 -65.02 1.06 Allowed 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 126.799 2.04 . . . . 71.129999999999995 108.282 175.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.8 m -128.69 156.83 41.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 123.157 0.583 . . . . 71.019999999999996 109.894 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.48 154.65 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.267 0.627 . . . . 50.25 110.192 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.2 p80 -62.42 -15.1 47.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 118.729 -0.653 . . . . 73.25 112.547 175.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.8 p -120.22 22.25 11.45 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.217 1.807 . . . . 74.109999999999999 112.319 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -84.94 -3.49 58.76 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 123.265 1.507 . . . . 73.239999999999995 112.713 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -94.53 -172.86 2.87 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 126.334 1.854 . . . . 71.319999999999993 109.47 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -127.21 175.59 8.04 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.366 0.666 . . . . 74.420000000000002 111.584 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -63.69 -32.69 74.26 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.563 0.745 . . . . 75.230000000000004 111.282 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.1 mtp180 -61.83 -37.29 83.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.497 0.719 . . . . 74.349999999999994 109.947 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.17 93.94 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.651 0.78 . . . . 63.109999999999999 110.867 175.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.62 -50.92 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.954 0.797 . . . . 62.140000000000001 109.965 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -62.11 -51.25 68.67 Favored 'General case' 0 C--O 1.23 0.059 0 N-CA-C 109.875 -0.417 . . . . 71.219999999999999 109.875 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.47 69.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.164 -0.922 . . . . 74.409999999999997 112.299 -176.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.07 -51.73 67.91 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.955 0.798 . . . . 74.549999999999997 110.661 169.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.11 -39.99 83.97 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.003 0.82 . . . . 72.409999999999997 111.487 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -77.12 38.45 0.22 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-N 119.285 0.948 . . . . 74.540000000000006 112.473 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -129.1 146.75 50.97 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.335 -1.357 . . . . 72.329999999999998 107.335 161.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -68.49 170.3 9.31 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.826 0.346 . . . . 74.140000000000001 110.483 163.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -47.53 -64.17 0.86 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 127.38 2.272 . . . . 64.549999999999997 110.786 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -31.12 71.84 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 123.365 0.666 . . . . 73.430000000000007 110.871 -172.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.84 -53.95 10.56 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 110.319 -1.112 . . . . 62.240000000000002 110.319 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.5 -37.63 75.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.8 1.24 . . . . 70.239999999999995 111.599 177.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.98 -43.32 95.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 119.447 1.021 . . . . 65.530000000000001 110.937 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.512 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -61.74 -45.07 95.53 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.992 0.901 . . . . 61.140000000000001 110.785 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.23 -37.5 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.939 0.896 . . . . 50.420000000000002 110.315 176.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.03 -48.6 20.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 119.057 0.844 . . . . 70.140000000000001 110.994 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -57.5 -41.74 81.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.592 -0.892 . . . . 72.340000000000003 108.592 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -82.65 -10.07 59.1 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 112.866 0.691 . . . . 74.349999999999994 112.866 -176.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -67.18 -61.03 2.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.805 -0.813 . . . . 74.519999999999996 108.805 166.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -65.74 -39.73 91.39 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 118.697 -0.668 . . . . 70.439999999999998 110.453 -178.9 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -82.73 54.63 2.74 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.289 1.436 . . . . 63.140000000000001 110.145 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.97 -172.75 4.13 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.853 2.061 . . . . 74.239999999999995 107.999 173.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -129.51 114.69 16.42 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.212 1.405 . . . . 73.120000000000005 108.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.97 24.39 7.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.651 2.38 . . . . 70.319999999999993 110.8 -176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.6 t -70.5 -22.64 62.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.05 1.34 . . . . 33.509999999999998 112.512 -177.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -125.41 12.6 8.14 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.509 1.123 . . . . 63.520000000000003 112.301 -171.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.2 p -90.84 140.42 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.883 0.765 . . . . 70.430000000000007 109.314 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -36.2 23.09 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 122.287 -0.258 . . . . 62.219999999999999 111.183 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -137.9 118.56 14.01 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.424 1.49 . . . . 72.239999999999995 107.303 -163.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -64.4 -39.14 93.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.171 0.804 . . . . 70.510000000000005 113.171 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -40.33 94.41 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 124.884 1.274 . . . . 72.140000000000001 107.677 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.16 -19.3 65.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.857 0.753 . . . . 42.140000000000001 112.61 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -79.3 -51.24 9.7 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 122.15 0.976 . . . . 73.439999999999998 108.591 173.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.73 -47.27 86.31 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.203 -1.362 . . . . 71.329999999999998 108.408 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.6 p -59.91 -26.69 66.12 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.768 1.627 . . . . 63.350000000000001 110.411 -176.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.2 -53.05 5.36 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.154 -0.779 . . . . 74.349999999999994 111.154 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.9 t -57.23 -40.58 74.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 117.375 0.587 . . . . 71.239999999999995 110.031 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.0 mtt -55.48 -45.08 77.01 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 121.358 -0.839 . . . . 62.310000000000002 111.073 175.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -63.5 -54.75 31.43 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 108.908 -0.775 . . . . 74.219999999999999 108.908 -171.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.3 t -63.83 -36.81 85.13 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.889 -0.577 . . . . 45.049999999999997 110.543 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.512 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 2.4 m-85 -58.26 -44.73 88.52 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 120.14 1.336 . . . . 74.329999999999998 113.36 174.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.04 -11.51 59.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.253 0.479 . . . . 64.549999999999997 111.487 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -130.43 75.14 1.64 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.244 1.418 . . . . 65.340000000000003 109.155 177.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -122.68 0.4 9.29 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.789 1.236 . . . . 70.409999999999997 114.11 -176.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.62 160.1 23.33 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.169 -1.048 . . . . 74.540000000000006 108.169 157.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.255 1.371 0 N-CA-C 105.939 -1.875 . . . . 73.109999999999999 105.939 159.561 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.396 0 N-CA-C 111.442 -0.663 . . . . 65.510000000000005 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.43 -172.83 3.0 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.921 1.688 . . . . 73.25 110.579 -177.647 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -45.15 -44.15 10.47 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.483 2.313 . . . . 71.510000000000005 110.343 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.76 -39.14 80.11 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.461 1.104 . . . . 74.519999999999996 110.317 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -53.12 -57.96 8.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.269 1.027 . . . . 71.450000000000003 111.204 -175.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -65.04 -39.05 92.77 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.25 -0.58 . . . . 72.450000000000003 110.554 -175.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.6 m -65.8 -36.79 84.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.168 0.44 . . . . 64.230000000000004 110.122 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.13 -37.18 86.2 Favored 'General case' 0 C--N 1.34 0.179 0 O-C-N 120.816 -1.177 . . . . 70.450000000000003 111.105 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.2 mm? -65.52 -18.58 65.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 119.13 -0.462 . . . . 72.420000000000002 111.79 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.74 -14.16 21.0 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.778 0.831 . . . . 65.040000000000006 111.511 173.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.23 -0.34 14.1 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.033 1.733 . . . . 70.25 112.382 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.29 14.91 24.82 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.716 -1.047 . . . . 62.229999999999997 113.304 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.8 mt -113.12 152.44 45.03 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 118.927 1.364 . . . . 74.420000000000002 111.815 -166.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.3 160.41 48.89 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.005 2.47 . . . . 71.140000000000001 110.911 172.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.509 ' HA ' HD11 ' A' ' 9' ' ' LEU . 14.7 tt0 -64.43 -46.0 85.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.252 -1.018 . . . . 64.519999999999996 108.252 178.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.79 -38.11 74.92 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.568 0.951 . . . . 71.329999999999998 113.568 -170.779 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.7 t -78.63 -43.05 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.605 -1.257 . . . . 53.119999999999997 107.605 178.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.3 -32.32 56.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.968 0.804 . . . . 22.199999999999999 111.927 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.02 -23.25 65.27 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 114.367 1.247 . . . . 64.329999999999998 114.367 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.84 -6.14 20.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 118.947 0.794 . . . . 73.120000000000005 111.92 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 25' ' ' TYR . 1.2 tt -104.66 -27.96 11.51 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 124.762 1.225 . . . . 74.549999999999997 111.59 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.04 -41.86 88.86 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.314 0.961 . . . . 53.229999999999997 111.484 173.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.96 -24.24 51.61 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.232 1.413 . . . . 73.450000000000003 114.002 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.423 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.0 mt -73.25 -18.12 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.801 0.841 . . . . 73.25 109.436 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.592 ' HE2' HD23 ' A' ' 21' ' ' LEU . 65.3 m-85 -99.79 -27.77 13.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.445 1.498 . . . . 74.109999999999999 112.651 175.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.3 t -58.87 -51.06 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-O 118.996 -0.526 . . . . 71.450000000000003 110.496 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.08 0.88 46.61 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.93 1.085 . . . . 62.420000000000002 113.93 -162.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 44.34 87.96 Favored Glycine 0 CA--C 1.529 0.92 0 O-C-N 121.245 -0.909 . . . . 64.239999999999995 112.016 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.4 mt -82.09 -74.59 0.34 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 126.552 1.941 . . . . 74.239999999999995 107.035 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 m -103.34 146.84 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 N-CA-C 113.83 1.048 . . . . 44.109999999999999 113.83 172.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.17 26.89 0.06 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 129.003 2.921 . . . . 72.340000000000003 116.46 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . 0.303 2.9 p80 55.46 -21.24 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.828 2.851 . . . . 63.020000000000003 116.75 -165.815 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.1 p -129.14 16.55 6.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.447 1.476 . . . . 70.049999999999997 112.118 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.73 -15.41 58.46 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.299 1.44 . . . . 70.120000000000005 113.709 -173.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.14 170.41 10.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.619 1.568 . . . . 74.049999999999997 111.601 -160.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -105.45 158.51 16.61 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.831 -0.803 . . . . 64.010000000000005 108.831 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -47.59 -46.86 28.67 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.769 2.028 . . . . 52.240000000000002 110.45 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -59.16 -35.19 73.09 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 122.987 0.515 . . . . 72.409999999999997 111.973 -176.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.88 62.38 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.442 -0.79 . . . . 73.019999999999996 110.291 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 6.9 mm -71.79 -41.12 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 74.150000000000006 110.135 175.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.64 -58.59 6.46 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.867 -0.79 . . . . 73.099999999999994 108.867 175.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.85 -40.2 63.19 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.245 1.018 . . . . 70.319999999999993 111.471 -174.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.2 mt -46.99 -54.09 10.94 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 124.424 1.09 . . . . 62.409999999999997 111.541 173.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -28.6 69.22 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.462 0.574 . . . . 72.219999999999999 111.773 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -73.25 -16.22 61.4 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.479 -0.763 . . . . 65.030000000000001 112.441 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -85.93 137.44 32.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.567 1.147 . . . . 74.530000000000001 110.937 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.36 166.01 3.28 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 113.341 -1.754 . . . . 72.319999999999993 110.677 156.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.14 -58.16 9.12 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 113.946 -1.479 . . . . 72.219999999999999 110.553 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.03 -30.95 70.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.874 0.369 . . . . 75.519999999999996 111.406 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.26 -66.98 2.44 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 108.564 -1.814 . . . . 54.039999999999999 108.564 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.5 -42.0 70.26 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.986 0.735 . . . . 51.200000000000003 112.986 -177.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.14 -41.61 88.72 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.763 0.825 . . . . 72.540000000000006 111.405 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.432 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -73.1 -42.51 62.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.361 0.264 . . . . 42.399999999999999 110.812 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 70.0 t -54.28 -29.85 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.442 1.497 . . . . 71.209999999999994 110.27 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.561 HD21 HD12 ' A' ' 21' ' ' LEU . 13.7 mt -77.48 -54.52 6.32 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.36 1.064 . . . . 74.310000000000002 109.013 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -56.76 -51.09 70.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 123.634 0.584 . . . . 71.439999999999998 109.869 -175.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -72.29 -7.5 49.8 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.267 0.84 . . . . 70.420000000000002 113.267 -172.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -93.64 -58.41 2.28 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 125.833 1.653 . . . . 72.219999999999999 110.216 174.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -58.05 -33.37 68.93 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.591 1.156 . . . . 70.129999999999995 110.885 178.159 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -76.77 52.33 0.83 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.247 1.819 . . . . 61.549999999999997 109.977 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m -154.73 171.56 19.35 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 120.23 -1.544 . . . . 71.109999999999999 109.814 168.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -110.68 96.98 6.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.084 1.354 . . . . 64.450000000000003 107.673 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.5 mt -89.65 -6.25 56.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 118.1 -0.952 . . . . 72.230000000000004 112.782 -164.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.84 -56.06 5.85 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 73.310000000000002 111.722 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -101.2 9.93 41.35 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.42 0.688 . . . . 72.209999999999994 112.415 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.6 t -73.5 104.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 106.803 -1.555 . . . . 72.430000000000007 106.803 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -62.67 -28.04 69.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.326 1.05 . . . . 72.409999999999997 113.251 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -129.15 96.15 4.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.996 0.918 . . . . 73.120000000000005 108.639 177.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -54.27 -33.83 59.48 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.218 1.007 . . . . 73.019999999999996 109.999 172.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 m -69.66 -51.04 38.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.789 1.635 . . . . 74.25 111.39 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.18 74.45 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.15 0.432 . . . . 74.219999999999999 110.393 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -64.73 -51.8 60.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.02 -0.733 . . . . 72.230000000000004 109.02 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.3 tp -67.62 -58.09 5.3 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.628 1.171 . . . . 73.420000000000002 110.205 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -22.54 66.94 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.601 -0.727 . . . . 74.120000000000005 110.983 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.42 -48.44 14.03 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.193 -0.782 . . . . 25.0 111.35 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.0 t -55.31 -45.19 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 118.453 1.126 . . . . 74.109999999999999 109.678 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.1 mtt -50.78 -51.41 50.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.471 0.578 . . . . 64.230000000000004 111.147 171.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -49.09 73.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.826 -0.607 . . . . 73.230000000000004 110.357 -174.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -46.47 89.46 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.379 0.536 . . . . 42.119999999999997 110.8 175.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.432 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 1.5 m-85 -54.28 -52.63 60.82 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.76 0.709 . . . . 73.129999999999995 111.84 -175.234 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -67.92 -9.33 44.26 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.132 0.573 . . . . 71.140000000000001 111.493 -177.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -135.19 62.26 1.64 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.379 1.872 . . . . 73.099999999999994 110.573 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -80.45 53.81 1.91 Allowed 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.702 -1.249 . . . . 74.5 109.616 166.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -89.82 -175.64 4.69 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.011 -1.107 . . . . 73.230000000000004 108.011 150.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm . . . . . 0 CA--C 1.497 -1.078 0 N-CA-C 105.343 -2.095 . . . . 74.010000000000005 105.343 -169.767 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.484 0 N-CA-C 109.563 -1.415 . . . . 43.439999999999998 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 t -101.83 -178.39 3.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.461 0.648 . . . . 71.129999999999995 110.734 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.91 -24.35 66.9 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.175 -0.466 . . . . 64.430000000000007 111.499 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.44 -40.84 83.66 Favored 'General case' 0 C--N 1.346 0.423 0 N-CA-C 109.022 -0.733 . . . . 71.150000000000006 109.022 -176.333 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -45.16 -53.44 8.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.853 1.261 . . . . 73.420000000000002 112.545 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -65.47 -41.6 93.16 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.224 -0.417 . . . . 72.430000000000007 111.602 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -65.66 -31.43 72.44 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.475 0.71 . . . . 71.319999999999993 110.769 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.53 -40.55 76.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.884 -1.135 . . . . 70.120000000000005 110.268 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 15' ' ' GLN . 1.1 mm? -62.14 -23.47 66.59 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.984 0.811 . . . . 62.340000000000003 111.579 176.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.82 -18.87 38.95 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.508 0.594 . . . . 53.020000000000003 111.647 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.38 -0.46 29.16 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.972 -1.08 . . . . 51.32 112.754 -161.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 7.09 45.67 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.429 1.014 . . . . 54.420000000000002 111.964 -171.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.0 144.92 28.66 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 118.504 1.152 . . . . 74.129999999999995 110.04 -172.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.72 163.21 38.02 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.117 1.878 . . . . 61.399999999999999 110.228 167.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.421 ' HA ' HD11 ' A' ' 9' ' ' LEU . 27.1 tt0 -57.7 -48.12 80.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.312 -0.996 . . . . 73.439999999999998 108.312 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HD3' HD11 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -60.46 -31.45 70.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 112.896 0.702 . . . . 75.209999999999994 112.896 -169.269 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.15 -51.5 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.288 1.435 . . . . 71.5 108.591 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -38.65 71.84 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.427 0.691 . . . . 73.530000000000001 111.98 -177.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.0 -48.1 52.64 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.804 1.642 . . . . 75.310000000000002 110.966 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.29 31.58 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 124.563 1.145 . . . . 72.540000000000006 110.465 -175.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.47 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -66.37 -42.83 87.44 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 119.419 1.008 . . . . 62.100000000000001 111.376 177.73 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -51.02 -41.52 59.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.337 1.055 . . . . 64.519999999999996 111.328 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -53.29 -36.62 61.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 127.594 2.358 . . . . 75.200000000000003 112.712 177.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.4 mt -74.5 -14.07 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.093 0.957 . . . . 63.539999999999999 108.64 -174.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.47 ' CE2' HD23 ' A' ' 21' ' ' LEU . 45.2 m-85 -100.58 -8.95 22.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.792 1.637 . . . . 72.5 112.086 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 84.5 t -78.55 -34.5 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 125.496 1.518 . . . . 74.239999999999995 111.265 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 -3.89 58.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.235 1.198 . . . . 51.240000000000002 114.235 -161.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 63.97 28.9 73.45 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 121.363 -0.836 . . . . 74.439999999999998 111.46 -163.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 mt -71.36 -81.94 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 128.253 2.621 . . . . 74.510000000000005 105.783 162.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.0 m -124.71 176.79 5.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 123.724 0.81 . . . . 71.120000000000005 111.48 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.37 155.25 20.21 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 125.184 1.393 . . . . 74.340000000000003 108.044 166.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -48.77 -32.32 8.41 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.605 1.562 . . . . 71.329999999999998 112.343 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.07 5.88 31.55 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.998 2.119 . . . . 71.099999999999994 113.47 -175.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.82 -15.21 63.44 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 119.276 -2.14 . . . . 72.5 114.522 -177.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.6 mt -95.89 136.94 35.66 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.753 0.821 . . . . 73.420000000000002 111.729 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.79 155.33 40.92 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.136 -1.431 . . . . 73.420000000000002 107.136 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.12 -32.6 71.16 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.787 -0.57 . . . . 71.540000000000006 110.961 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -61.89 -29.63 70.33 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.684 0.794 . . . . 73.140000000000001 112.773 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.97 -35.87 31.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.644 -0.502 . . . . 73.340000000000003 109.644 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mm -60.86 -43.26 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.657 0.662 . . . . 70.409999999999997 109.28 172.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.24 -55.85 24.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.431 1.092 . . . . 70.109999999999999 110.244 171.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.97 -37.76 74.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 119.224 -0.417 . . . . 54.030000000000001 111.743 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -42.28 78.81 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.479 0.712 . . . . 74.239999999999995 111.596 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -25.89 67.08 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.627 0.648 . . . . 74.510000000000005 112.585 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -75.87 -13.28 60.27 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 120.007 1.276 . . . . 64.209999999999994 113.118 -173.318 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -90.69 135.53 33.65 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.514 1.526 . . . . 54.100000000000001 108.714 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -65.97 170.01 6.06 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.278 -0.873 . . . . 54.140000000000001 110.595 163.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -46.78 -64.39 0.78 Allowed 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 126.997 2.119 . . . . 73.420000000000002 111.52 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -64.15 -36.69 84.85 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.009 0.524 . . . . 74.230000000000004 111.817 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -64.87 -46.36 89.72 Favored Glycine 0 C--N 1.34 0.797 0 N-CA-C 110.617 -0.993 . . . . 54.32 110.617 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.56 82.01 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.932 1.693 . . . . 73.510000000000005 110.395 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.527 HD11 ' HD3' ' A' ' 16' ' ' LYS . 48.0 mt -55.19 -45.63 75.81 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.713 0.688 . . . . 74.5 110.362 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.15 82.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.74 0.274 . . . . 72.219999999999999 111.74 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 77' ' ' MET . 41.9 t -56.64 -41.94 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.29 1.036 . . . . 74.5 110.564 175.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.15 -43.29 78.61 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.668 -0.645 . . . . 74.409999999999997 110.213 -174.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -62.93 -39.81 95.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.384 -0.969 . . . . 71.230000000000004 108.384 -176.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -74.19 -31.14 62.54 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 118.273 0.488 . . . . 75.400000000000006 111.231 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.71 -57.99 10.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.916 0.486 . . . . 73.409999999999997 109.892 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -21.97 66.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.336 -0.84 . . . . 74.430000000000007 112.105 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -74.99 49.01 0.41 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.42 1.009 . . . . 62.439999999999998 109.564 164.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.7 m -152.52 150.05 29.17 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.362 1.465 . . . . 52.310000000000002 111.566 172.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -97.58 87.21 4.02 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 122.946 1.355 . . . . 71.299999999999997 109.617 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 mt -76.76 46.33 0.45 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.619 1.968 . . . . 43.399999999999999 111.378 -172.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.8 m -95.04 -5.46 44.38 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.526 1.531 . . . . 64.530000000000001 112.607 167.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -125.72 41.2 3.57 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.498 -1.376 . . . . 70.109999999999999 111.463 -175.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.69 100.58 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 124.899 1.279 . . . . 74.329999999999998 109.959 -168.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.4 ' H ' ' CD ' ' A' ' 67' ' ' GLN . 0.1 OUTLIER -65.69 -47.07 76.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.32 1.048 . . . . 74.129999999999995 112.599 176.497 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -107.43 99.03 8.57 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 106.589 -1.634 . . . . 65.439999999999998 106.589 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -60.35 -34.72 74.24 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.079 0.466 . . . . 74.420000000000002 109.964 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 72.5 p -64.71 -55.53 19.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.634 1.174 . . . . 61.329999999999998 110.659 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.88 -26.73 67.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 119.081 -0.485 . . . . 73.239999999999995 112.028 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -63.31 -54.34 38.55 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.696 0.68 . . . . 72.230000000000004 109.866 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.72 -52.88 63.8 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.967 0.907 . . . . 74.400000000000006 109.613 -178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.11 -29.29 65.38 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 115.749 -0.66 . . . . 54.32 112.194 176.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.61 -39.15 90.71 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.708 1.147 . . . . 64.400000000000006 112.263 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 94.9 t -64.67 -48.52 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 107.67 -1.233 . . . . 74.430000000000007 107.67 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.402 ' HG3' HG11 ' A' ' 54' ' ' VAL . 6.0 mtp -58.52 -33.14 69.52 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.011 -1.056 . . . . 71.400000000000006 112.297 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -58.05 -58.15 9.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.84 -0.8 . . . . 70.400000000000006 108.84 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.9 t -62.49 -50.1 72.73 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.934 -0.555 . . . . 74.120000000000005 110.157 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -49.14 -28.66 4.51 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 117.475 2.398 . . . . 65.239999999999995 117.475 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -115.28 0.24 13.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.337 0.971 . . . . 63.5 112.659 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -127.68 74.61 1.54 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.738 2.015 . . . . 72.319999999999993 108.799 159.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 30.3 ptt85 -124.64 7.79 8.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.961 1.304 . . . . 75.430000000000007 112.688 -177.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.63 49.87 1.73 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.878 2.471 . . . . 52.439999999999998 110.052 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm . . . . . 0 C--O 1.247 0.946 0 C-N-CA 125.538 1.535 . . . . 72.219999999999999 110.448 179.797 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.775 0 N-CA-C 110.569 -1.013 . . . . 62.149999999999999 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -127.16 -165.37 1.46 Allowed 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.985 0.914 . . . . 74.530000000000001 110.755 -173.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -55.07 -28.95 56.26 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 113.921 1.082 . . . . 73.549999999999997 113.921 -166.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -34.65 78.54 Favored 'General case' 0 N--CA 1.461 0.103 0 C-N-CA 123.525 0.73 . . . . 71.430000000000007 110.447 -177.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -54.79 -47.53 73.85 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.491 1.116 . . . . 74.319999999999993 110.348 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -62.26 -49.48 75.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.947 -0.549 . . . . 71.530000000000001 110.378 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -55.08 -49.55 71.4 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.425 1.09 . . . . 70.450000000000003 109.703 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.4 mt -65.8 -39.2 90.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 O-C-N 121.67 -0.644 . . . . 72.150000000000006 111.257 -177.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -64.13 -15.13 59.09 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 118.768 -0.634 . . . . 72.430000000000007 111.522 175.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.77 2.35 27.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.895 1.678 . . . . 74.230000000000004 112.711 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -96.95 24.3 6.35 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.039 1.336 . . . . 71.340000000000003 111.861 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.95 16.9 78.29 Favored Glycine 0 CA--C 1.525 0.692 0 O-C-N 121.18 -0.95 . . . . 62.149999999999999 112.979 -177.57 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -111.02 156.82 40.26 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 118.65 1.225 . . . . 72.510000000000005 111.371 -173.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.82 173.92 13.69 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.259 3.306 . . . . 63.439999999999998 113.917 175.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -76.68 -46.01 27.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 126.377 1.871 . . . . 73.549999999999997 111.055 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -57.37 -42.08 81.41 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 118.948 0.794 . . . . 65.25 111.34 -176.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.3 t -58.49 -63.28 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 125.017 1.327 . . . . 72.109999999999999 108.107 168.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.21 -47.27 24.44 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.161 1.385 . . . . 71.530000000000001 112.012 -171.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -53.01 -56.9 12.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.624 1.569 . . . . 71.030000000000001 110.828 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -67.4 -38.65 85.01 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.907 -0.405 . . . . 50.43 109.907 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.22 -42.65 65.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.206 1.402 . . . . 70.540000000000006 110.976 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -49.82 -50.52 44.83 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.017 1.727 . . . . 73.549999999999997 110.461 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.17 -16.3 52.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.947 1.699 . . . . 73.25 113.617 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.2 mt -73.75 -31.38 31.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 120.994 -1.066 . . . . 64.5 108.707 175.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -85.39 -48.38 9.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.882 0.873 . . . . 74.549999999999997 110.228 -177.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -53.83 -39.53 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.58 0.752 . . . . 73.230000000000004 111.758 -175.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.75 0.31 7.35 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.129 0.971 . . . . 73.219999999999999 112.888 -175.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.83 7.01 71.63 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 125.327 1.442 . . . . 63.299999999999997 112.793 174.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 59' ' ' LYS . 39.8 mt -75.91 -59.8 2.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.13 0.965 . . . . 74.129999999999995 109.704 -166.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.7 167.25 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.24 1.016 . . . . 70.219999999999999 112.248 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.2 155.26 27.47 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.774 0.829 . . . . 71.200000000000003 109.779 171.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -73.8 -38.18 64.7 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.949 -0.469 . . . . 72.310000000000002 110.661 175.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.33 7.72 9.0 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.72 0.691 . . . . 72.219999999999999 112.395 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.02 -4.36 40.84 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.991 1.108 . . . . 73.129999999999995 113.991 -166.256 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.492 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -107.46 169.44 8.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.727 1.211 . . . . 73.409999999999997 110.325 -175.832 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -108.36 172.11 7.02 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.27 1.428 . . . . 74.340000000000003 109.836 -173.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.1 -44.64 64.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.037 1.335 . . . . 74.409999999999997 111.344 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -57.56 -22.84 47.12 Favored 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 125.795 1.638 . . . . 73.400000000000006 113.673 175.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.2 -36.38 34.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.939 -1.029 . . . . 74.329999999999998 110.283 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.8 mm -63.41 -59.75 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 108.218 -1.031 . . . . 74.140000000000001 108.218 172.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -58.98 -47.55 84.75 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.231 1.012 . . . . 70.200000000000003 111.189 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -30.14 66.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 118.012 -0.994 . . . . 71.439999999999998 111.712 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.3 -38.35 65.82 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-N 119.728 1.149 . . . . 65.5 111.204 170.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -64.01 -26.42 68.56 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.777 0.717 . . . . 74.209999999999994 111.525 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -74.88 -18.04 60.49 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.685 -0.634 . . . . 74.430000000000007 112.051 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -88.52 140.5 29.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.203 1.001 . . . . 71.340000000000003 109.521 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -69.23 176.22 3.42 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.27 -1.332 . . . . 70.140000000000001 109.367 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -54.76 -59.28 4.93 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.22 -1.354 . . . . 74.25 111.673 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.56 -27.89 45.91 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 119.64 -0.219 . . . . 51.520000000000003 110.972 -170.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.17 -48.96 79.29 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.424 -1.47 . . . . 65.239999999999995 109.424 171.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.84 -43.99 94.33 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.807 0.803 . . . . 72.129999999999995 110.576 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.91 -36.29 83.47 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.5 -0.75 . . . . 54.340000000000003 112.012 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -43.85 82.56 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.029 0.831 . . . . 72.099999999999994 110.517 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 65.5 t -55.07 -42.09 62.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 123.255 0.622 . . . . 64.510000000000005 109.729 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.42 -38.06 56.14 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 121.77 -0.581 . . . . 61.409999999999997 111.653 -175.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.2 pt20 -67.45 -28.85 68.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.727 -0.654 . . . . 62.32 110.617 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -75.42 -36.28 60.82 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.925 0.784 . . . . 73.430000000000007 110.48 171.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -56.48 -57.74 11.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.976 0.91 . . . . 72.299999999999997 111.63 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HE2' HD12 ' A' ' 29' ' ' LEU . 34.0 ttmt -63.54 -30.15 71.31 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.548 0.613 . . . . 71.439999999999998 111.46 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -73.83 10.23 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.323 1.449 . . . . 74.030000000000001 113.117 -172.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.2 m -112.57 165.98 11.75 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.486 1.514 . . . . 61.32 111.666 -173.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -95.99 105.54 17.59 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 107.713 -1.218 . . . . 71.329999999999998 107.713 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.541 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 91.8 mt -92.22 -7.28 48.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.698 -0.683 . . . . 72.140000000000001 112.823 -171.451 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 m -60.29 -27.01 66.95 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.433 1.642 . . . . 61.340000000000003 115.433 -169.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -131.72 16.11 4.82 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.344 1.057 . . . . 62.219999999999999 111.439 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -64.04 154.28 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.573 1.149 . . . . 51.009999999999998 109.966 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -63.64 1.24 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.374 -0.376 . . . . 74.400000000000006 110.355 -178.291 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -127.1 134.76 50.18 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 106.638 -1.616 . . . . 52.399999999999999 106.638 166.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.541 ' HE3' ' HB3' ' A' ' 63' ' ' LEU . 29.8 mmtm -59.57 -27.4 66.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.084 0.865 . . . . 61.219999999999999 111.051 172.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.7 p -72.66 -53.08 12.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.473 0.709 . . . . 70.439999999999998 110.398 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.96 -38.91 65.47 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.8 0.44 . . . . 64.200000000000003 111.425 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -60.05 -51.78 68.17 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.732 0.777 . . . . 65.409999999999997 109.531 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.9 tp -62.17 -52.07 65.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.705 -0.85 . . . . 73.319999999999993 108.705 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 11.9 t -57.65 -28.22 63.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.03 0.932 . . . . 62.240000000000002 111.448 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.43 -49.6 50.21 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 111.16 -0.776 . . . . 30.120000000000001 111.16 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.94 -37.85 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 117.826 0.813 . . . . 74.129999999999995 111.254 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.2 mtt -55.21 -44.83 75.76 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.0 -1.063 . . . . 64.200000000000003 111.09 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -58.5 -50.68 72.86 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.01 0.924 . . . . 73.409999999999997 110.723 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 t -68.63 -36.35 78.51 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.605 -1.188 . . . . 63.539999999999999 111.112 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -65.23 -31.11 72.1 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 122.245 2.293 . . . . 63.200000000000003 112.798 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 mmm-85 -69.52 -28.19 65.82 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 121.173 -0.954 . . . . 73.5 111.279 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -141.39 81.86 1.8 Allowed 'General case' 0 C--O 1.241 0.65 0 C-N-CA 125.857 1.663 . . . . 63.43 110.471 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -132.5 82.11 1.99 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 105.318 -2.105 . . . . 65.040000000000006 105.318 169.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -132.38 172.48 12.41 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.898 1.679 . . . . 73.310000000000002 109.561 175.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.426 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 7.6 mmpt? . . . . . 0 C--O 1.249 1.041 0 C-N-CA 128.97 2.908 . . . . 73.310000000000002 110.114 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.552 0 N-CA-C 110.564 -1.014 . . . . 55.549999999999997 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.55 -179.97 7.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.675 1.226 . . . . 75.219999999999999 110.476 174.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -28.97 67.13 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 114.733 -1.121 . . . . 74.030000000000001 112.219 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -52.71 -31.35 37.22 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.865 1.266 . . . . 60.350000000000001 112.86 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.4 -42.82 74.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.264 0.626 . . . . 74.25 110.948 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -64.27 -46.44 83.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.279 1.031 . . . . 73.209999999999994 111.999 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -70.24 -30.36 67.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.022 0.828 . . . . 70.25 110.365 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.58 -47.87 79.73 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 120.86 -1.15 . . . . 63.219999999999999 109.505 172.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 15' ' ' GLN . 29.0 mt -65.25 -15.04 62.06 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.928 0.891 . . . . 61.109999999999999 113.175 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -87.88 -42.14 12.72 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.501 1.92 . . . . 44.149999999999999 110.431 174.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.16 15.81 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.684 2.794 . . . . 74.140000000000001 112.902 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.35 12.33 84.66 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 127.174 2.321 . . . . 54.210000000000001 112.641 175.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.8 mt -85.71 145.98 42.84 Favored Pre-proline 0 C--O 1.237 0.417 0 CA-C-N 118.424 1.112 . . . . 41.409999999999997 108.908 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -71.02 167.75 25.18 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.578 2.186 . . . . 53.450000000000003 112.478 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.504 ' HA ' HD21 ' A' ' 9' ' ' LEU . 46.6 tt0 -70.84 -48.07 55.93 Favored 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 124.974 1.309 . . . . 70.329999999999998 110.053 -174.05 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -62.45 -40.15 95.67 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 119.457 -0.897 . . . . 50.409999999999997 111.107 -172.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 76.6 t -60.53 -57.07 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.178 -1.045 . . . . 72.150000000000006 108.178 172.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.72 -42.1 62.02 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.411 1.085 . . . . 61.030000000000001 113.55 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.12 -52.34 64.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.96 0.904 . . . . 73.510000000000005 110.566 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -28.58 62.34 Favored 'General case' 0 N--CA 1.461 0.085 0 O-C-N 121.694 -0.629 . . . . 74.239999999999995 110.144 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.541 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -68.23 -35.24 77.65 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.731 0.696 . . . . 74.230000000000004 111.28 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -53.03 -43.43 66.57 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.731 1.213 . . . . 64.450000000000003 111.57 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -64.57 -15.34 60.89 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 125.633 1.573 . . . . 72.549999999999997 113.883 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -76.5 -42.52 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.921 -1.14 . . . . 71.420000000000002 107.921 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.541 ' CE2' HD23 ' A' ' 21' ' ' LEU . 53.2 m-85 -84.39 -10.47 57.53 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 113.586 0.958 . . . . 74.319999999999993 113.586 -172.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.4 t -86.59 -19.92 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 119.081 0.855 . . . . 72.340000000000003 110.576 170.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.64 7.26 30.71 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.272 -0.893 . . . . 61.409999999999997 113.371 -165.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.19 5.55 48.95 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.31 -0.869 . . . . 54.340000000000003 113.848 -175.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -77.1 -61.08 2.1 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.805 1.302 . . . . 62.210000000000001 109.15 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.14 -174.25 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 123.664 0.785 . . . . 63.130000000000003 110.634 176.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -124.65 154.96 39.96 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.499 2.32 . . . . 73.409999999999997 107.585 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -57.91 -19.47 30.04 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.699 1.0 . . . . 72.349999999999994 113.699 -174.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -104.41 15.35 28.38 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.832 -1.167 . . . . 64.430000000000007 111.871 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -67.41 -18.48 65.13 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.92 -1.737 . . . . 71.219999999999999 114.228 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 70' ' ' SER . 85.2 mt -90.58 167.81 12.27 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.703 0.801 . . . . 75.319999999999993 111.59 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.97 156.84 17.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.629 -1.619 . . . . 55.450000000000003 106.629 171.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -64.35 -30.02 71.08 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.564 -0.71 . . . . 70.439999999999998 110.27 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -55.12 -22.48 16.83 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.446 1.098 . . . . 64.25 113.611 170.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -92.94 -44.52 8.4 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.004 1.322 . . . . 73.349999999999994 110.925 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.25 -42.53 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 119.146 0.885 . . . . 43.109999999999999 109.36 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -51.09 -49.3 60.96 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.498 1.119 . . . . 74.219999999999999 111.135 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.8 92.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.903 0.481 . . . . 63.020000000000003 110.092 -172.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 mt -58.44 -34.19 70.55 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.598 0.592 . . . . 73.120000000000005 112.598 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -60.54 -26.99 67.3 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 119.126 -0.464 . . . . 71.310000000000002 111.54 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -80.13 -18.19 50.5 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.81 1.041 . . . . 72.209999999999994 113.81 -168.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -87.12 155.41 20.13 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.008 1.323 . . . . 72.349999999999994 110.006 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -79.56 -177.66 5.93 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.273 1.429 . . . . 74.109999999999999 110.397 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -52.14 -70.86 0.08 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.109 1.764 . . . . 73.540000000000006 110.492 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -60.92 -45.59 94.05 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 124.886 1.275 . . . . 75.450000000000003 109.994 -174.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.564 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -55.78 -54.7 33.22 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 110.207 -1.157 . . . . 52.009999999999998 110.207 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.57 76.32 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.882 0.841 . . . . 65.450000000000003 110.672 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.61 -41.54 66.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.207 1.003 . . . . 75.409999999999997 110.815 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.98 79.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.882 0.31 . . . . 74.129999999999995 110.505 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 50' ' ' GLY . 11.0 t -58.97 -34.99 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 124.474 1.109 . . . . 74.540000000000006 110.471 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.9 -43.24 83.91 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.498 0.719 . . . . 75.209999999999994 109.985 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -43.97 92.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.122 -1.436 . . . . 72.230000000000004 107.122 -177.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -76.3 -33.71 59.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.488 -0.56 . . . . 62.409999999999997 109.488 -168.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -60.15 -62.7 1.68 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.471 1.108 . . . . 72.349999999999994 110.785 171.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -44.54 62.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.967 1.707 . . . . 74.430000000000007 111.701 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.22 15.05 0.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.852 1.261 . . . . 74.209999999999994 113.47 -173.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.7 m -112.53 173.68 6.26 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.478 1.511 . . . . 52.030000000000001 111.383 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -103.41 123.94 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.498 -1.667 . . . . 63.509999999999998 106.498 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.8 mt -105.68 -9.55 17.26 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 125.256 1.423 . . . . 74.209999999999994 112.242 -171.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.5 m -56.68 -26.81 57.43 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.717 2.007 . . . . 75.319999999999993 114.637 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -122.91 11.57 9.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.573 1.149 . . . . 72.420000000000002 110.924 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.7 t -71.38 127.83 33.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 O-C-N 120.891 -1.13 . . . . 75.329999999999998 108.205 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -64.29 -56.73 12.51 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.136 1.775 . . . . 52.43 110.379 -175.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -128.77 126.01 39.05 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 105.291 -2.114 . . . . 75.329999999999998 105.291 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -60.96 -27.78 68.5 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.558 0.536 . . . . 73.430000000000007 111.629 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . 0.402 ' HB3' ' HA ' ' A' ' 35' ' ' LEU . 12.4 p -73.77 -54.05 8.92 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.127 2.171 . . . . 73.430000000000007 110.81 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.01 64.69 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 118.356 0.525 . . . . 71.319999999999993 111.984 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -67.21 -46.5 73.68 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 120.603 0.24 . . . . 61.219999999999999 110.535 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -62.54 -42.88 99.81 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.811 0.444 . . . . 73.349999999999994 110.171 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.64 -28.4 63.67 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.14 -0.933 . . . . 72.519999999999996 112.557 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.6 -55.98 6.33 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.356 0.979 . . . . 21.52 111.907 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 22.4 t -62.05 -39.97 85.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 118.023 0.911 . . . . 71.530000000000001 109.863 -173.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 28.7 mtm -57.21 -42.1 80.7 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.483 -1.385 . . . . 61.340000000000003 111.491 172.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -61.76 -38.86 89.58 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 121.79 -0.569 . . . . 74.120000000000005 110.654 -177.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -50.89 61.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.371 -0.823 . . . . 72.239999999999995 110.515 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.556 ' CG ' HG22 ' A' ' 54' ' ' VAL . 11.5 m-85 -54.22 -32.68 56.46 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.557 0.947 . . . . 72.530000000000001 113.557 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -13.53 61.24 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 114.227 1.195 . . . . 72.209999999999994 114.227 175.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.18 73.9 1.57 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 125.053 1.341 . . . . 73.109999999999999 108.497 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.9 mtp85 -140.29 24.69 2.29 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.819 2.448 . . . . 74.349999999999994 110.002 175.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.18 94.35 1.54 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.992 0.917 . . . . 45.310000000000002 108.818 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.968 0 C-N-CA 127.537 2.335 . . . . 61.32 104.918 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.698 0 N-CA-C 110.287 -1.125 . . . . 61.020000000000003 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -119.43 178.9 4.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.555 0.742 . . . . 61.310000000000002 110.845 177.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -31.98 46.18 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.726 1.211 . . . . 75.420000000000002 113.769 -176.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -57.85 -33.9 69.15 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.358 1.063 . . . . 63.340000000000003 111.739 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -52.84 -56.72 13.74 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.298 1.039 . . . . 75.409999999999997 111.657 -172.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -57.93 -32.33 67.68 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.636 0.775 . . . . 75.099999999999994 111.536 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.0 m -67.18 -33.64 75.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 117.917 -1.039 . . . . 73.209999999999994 110.907 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.623 ' HG ' HD22 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -62.48 -39.81 94.64 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.698 2.044 . . . . 73.239999999999995 110.189 175.671 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.9 mm? -66.51 -16.56 64.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.502 0.721 . . . . 71.409999999999997 112.076 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -93.51 -39.4 10.89 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.498 1.919 . . . . 72.319999999999993 109.728 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.417 ' O ' ' HE2' ' A' ' 44' ' ' LYS . . . -70.35 8.0 0.9 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 129.805 3.242 . . . . 72.129999999999995 112.913 -174.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 109.47 -0.37 30.9 Favored Glycine 0 N--CA 1.439 -1.158 0 C-N-CA 124.979 1.276 . . . . 73.129999999999995 113.577 172.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -105.3 154.76 38.71 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 119.275 1.537 . . . . 72.0 112.329 -162.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -78.63 172.76 14.65 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.066 2.51 . . . . 62.409999999999997 111.789 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.459 ' HA ' HD11 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -74.24 -42.46 59.67 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 118.219 -0.896 . . . . 62.039999999999999 110.712 -174.09 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -64.72 -41.62 95.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 118.732 -1.187 . . . . 64.439999999999998 110.565 -167.213 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.9 t -58.07 -56.46 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 125.59 1.556 . . . . 55.100000000000001 108.739 168.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -37.16 67.85 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.037 0.754 . . . . 53.520000000000003 113.037 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.426 ' C ' ' HE3' ' A' ' 20' ' ' LYS . 3.8 mt-10 -63.33 -20.66 65.7 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.264 1.026 . . . . 73.019999999999996 112.744 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HE3' ' C ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -98.25 -32.48 11.54 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.23 0.923 . . . . 74.239999999999995 110.46 170.127 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.731 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -68.17 -31.67 71.38 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 125.116 1.366 . . . . 64.319999999999993 111.129 -175.857 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -54.52 -51.17 65.98 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 126.193 1.797 . . . . 71.219999999999999 112.033 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.91 -34.52 28.76 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.672 2.389 . . . . 52.219999999999999 112.503 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.9 mt -63.42 -28.17 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 108.447 -0.946 . . . . 73.420000000000002 108.447 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.731 ' HE2' HD23 ' A' ' 21' ' ' LEU . 34.6 m-85 -104.42 13.11 32.52 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.804 1.642 . . . . 74.140000000000001 112.805 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -111.06 -36.18 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.306 1.042 . . . . 73.209999999999994 109.912 173.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.93 9.62 3.45 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.009 -1.057 . . . . 74.150000000000006 112.981 -174.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.03 11.46 66.89 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 118.999 -0.889 . . . . 64.349999999999994 113.147 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.495 HD12 ' HE2' ' A' ' 59' ' ' LYS . 88.6 mt -66.12 -65.85 0.62 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.522 1.161 . . . . 61.450000000000003 108.121 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG23 ' CE1' ' A' ' 25' ' ' TYR . 27.3 m -135.45 164.02 34.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 O-C-N 123.238 0.336 . . . . 75.420000000000002 111.213 -173.674 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -90.15 155.2 19.2 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.208 1.003 . . . . 75.409999999999997 110.269 175.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -63.01 -23.81 67.63 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.259 -0.901 . . . . 63.340000000000003 112.209 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -100.5 12.88 36.32 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.76 1.022 . . . . 73.319999999999993 113.76 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.22 -26.35 62.0 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.601 -1.312 . . . . 75.439999999999998 112.579 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.9 mt -76.51 156.57 32.84 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.381 0.672 . . . . 71.349999999999994 110.835 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -110.25 173.59 6.26 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.834 1.653 . . . . 73.030000000000001 108.996 171.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -35.76 75.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 75.310000000000002 111.322 -164.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -66.02 -20.43 66.18 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 118.504 -0.76 . . . . 75.310000000000002 111.975 -176.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.64 18.52 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.309 0.959 . . . . 72.439999999999998 110.797 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.3 mm -67.09 -38.94 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 108.344 -0.984 . . . . 72.040000000000006 108.344 174.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -61.59 -45.56 93.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.481 -0.762 . . . . 74.319999999999993 110.473 172.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.13 -42.85 95.68 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.273 -0.394 . . . . 64.030000000000001 111.48 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.82 -49.08 74.23 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.978 0.911 . . . . 74.409999999999997 111.447 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -53.23 -19.53 3.21 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.818 1.647 . . . . 72.120000000000005 113.931 178.921 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.57 -20.36 26.55 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 120.168 1.349 . . . . 75.310000000000002 114.224 -170.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -90.0 152.38 21.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.141 0.976 . . . . 71.049999999999997 111.127 -165.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -74.03 -175.51 2.22 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.486 -1.234 . . . . 74.010000000000005 110.337 164.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -53.37 -68.0 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 124.71 1.204 . . . . 75.030000000000001 112.089 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -72.04 -35.3 69.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.086 -0.709 . . . . 73.409999999999997 109.086 -173.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.99 -46.12 70.02 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 110.93 -0.868 . . . . 75.120000000000005 110.93 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.17 -51.53 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 118.365 -0.826 . . . . 75.329999999999998 109.686 177.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.07 -43.45 70.29 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.01 0.924 . . . . 74.409999999999997 111.478 -178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.406 1.082 . . . . 70.010000000000005 111.027 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 89.6 t -57.69 -44.31 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 109.434 -0.58 . . . . 74.329999999999998 109.434 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -69.14 -49.12 59.84 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 123.487 0.715 . . . . 64.25 109.285 -173.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -51.35 -60.41 3.15 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 127.154 2.181 . . . . 61.109999999999999 108.298 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 37.6 tt0 -63.86 -35.48 80.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.188 0.518 . . . . 71.230000000000004 110.649 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -66.53 -55.78 13.92 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.856 0.862 . . . . 71.340000000000003 110.891 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE2' HD12 ' A' ' 29' ' ' LEU . 2.0 ttmm -64.29 -29.71 70.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.777 0.831 . . . . 71.25 111.997 177.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -76.55 33.81 0.14 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.694 1.997 . . . . 65.530000000000001 111.299 172.304 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -140.93 171.57 13.89 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.645 2.378 . . . . 64.340000000000003 109.768 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -119.83 121.12 38.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.743 2.017 . . . . 64.450000000000003 106.696 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 22.1 mt -112.72 7.77 18.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.816 1.647 . . . . 75.049999999999997 112.213 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.4 t -58.67 -30.93 67.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.674 1.59 . . . . 71.010000000000005 111.724 -173.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -120.39 41.92 3.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 124.296 1.038 . . . . 75.040000000000006 109.424 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.6 t -129.74 111.05 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 124.37 1.068 . . . . 74.010000000000005 108.477 171.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -57.34 -64.28 0.94 Allowed 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.52 0.728 . . . . 75.439999999999998 109.571 171.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -81.25 89.36 6.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.831 0.824 . . . . 74.239999999999995 109.988 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -61.74 -37.01 82.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.615 -0.72 . . . . 75.129999999999995 111.112 178.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 p -61.94 -56.28 20.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 124.656 1.182 . . . . 64.450000000000003 108.715 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.48 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . . . -63.01 -20.7 65.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.023 1.12 . . . . 40.549999999999997 114.023 -174.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -73.98 -56.37 5.03 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.641 -0.874 . . . . 64.030000000000001 108.641 174.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.664 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.9 OUTLIER -60.68 -48.51 81.48 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 125.077 1.351 . . . . 62.310000000000002 109.36 -172.396 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 71' ' ' ALA . 1.7 p -59.16 -30.58 68.27 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.198 -1.365 . . . . 72.239999999999995 109.443 -175.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.2 -45.36 71.34 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 125.039 1.304 . . . . 43.509999999999998 111.818 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.3 t -57.5 -40.79 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 118.964 1.382 . . . . 71.409999999999997 109.544 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.664 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -62.72 -36.18 82.16 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.828 -1.17 . . . . 74.219999999999999 110.931 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.0 tttp -62.69 -56.89 13.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.033 -0.729 . . . . 54.340000000000003 109.033 -176.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.94 -51.48 61.26 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.244 -0.884 . . . . 63.140000000000001 108.98 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.47 -33.84 73.17 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 115.355 1.613 . . . . 75.129999999999995 115.355 -173.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.12 -10.22 59.75 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.539 0.609 . . . . 75.030000000000001 111.22 177.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -138.12 68.85 1.39 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.947 2.099 . . . . 42.450000000000003 109.333 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -119.99 64.33 0.82 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.892 1.677 . . . . 70.319999999999993 107.446 174.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.17 -164.38 0.94 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 125.428 1.491 . . . . 63.009999999999998 108.812 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.07 0 C-N-CA 125.035 1.334 . . . . 73.420000000000002 108.468 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.665 0 N-CA-C 111.439 -0.664 . . . . 75.5 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.35 179.38 7.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 122.562 1.172 . . . . 42.109999999999999 109.891 168.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -52.35 -31.8 35.29 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.612 2.365 . . . . 75.099999999999994 113.776 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -66.11 -34.73 78.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.12 0.568 . . . . 64.310000000000002 109.87 -172.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -45.12 -54.12 7.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.879 1.671 . . . . 73.150000000000006 111.998 -176.629 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -70.27 -39.69 74.79 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 112.199 0.444 . . . . 73.230000000000004 112.199 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.8 m -66.43 -34.42 77.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.115 0.566 . . . . 72.209999999999994 110.389 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.03 -48.22 77.16 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.293 -0.879 . . . . 75.540000000000006 110.308 171.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 21.8 mt -60.32 -21.38 61.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.928 0.891 . . . . 75.340000000000003 112.0 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -81.85 -28.38 33.06 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.286 0.634 . . . . 71.519999999999996 110.917 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.28 11.27 1.99 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.208 1.403 . . . . 64.340000000000003 112.11 -167.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.06 5.36 53.29 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 124.465 1.031 . . . . 71.230000000000004 112.48 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.8 mt -97.51 145.44 29.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 118.267 1.034 . . . . 62.409999999999997 111.022 -165.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.87 179.58 3.13 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 125.187 3.925 . . . . 72.230000000000004 112.72 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -54.91 8.83 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 120.567 -1.333 . . . . 75.430000000000007 109.026 172.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -65.39 -31.97 73.35 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 113.369 0.877 . . . . 74.209999999999994 113.369 -160.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.4 t -74.68 -54.09 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.738 -1.208 . . . . 72.25 107.738 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.17 -35.88 38.34 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.929 1.292 . . . . 51.32 112.033 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -36.14 68.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.098 0.959 . . . . 73.120000000000005 112.585 177.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.46 -34.96 16.25 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.082 -1.011 . . . . 74.230000000000004 110.16 172.107 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.546 HD12 HD21 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -73.19 -25.05 60.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.629 1.171 . . . . 64.519999999999996 112.715 -168.634 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -56.68 -47.6 79.49 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.071 0.948 . . . . 75.510000000000005 110.761 175.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.94 -30.45 64.03 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.939 1.695 . . . . 64.439999999999998 112.144 -174.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.3 mt -64.58 -31.62 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.834 0.853 . . . . 44.340000000000003 109.328 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.482 ' HE2' HD23 ' A' ' 21' ' ' LEU . 81.2 m-85 -85.94 -21.73 27.77 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.506 0.558 . . . . 63.520000000000003 112.506 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 64.1 t -65.91 -50.94 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 118.694 0.679 . . . . 70.219999999999999 110.472 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.424 ' HB3' ' CD1' ' A' ' 29' ' ' LEU . . . -75.63 -7.25 53.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.628 0.771 . . . . 73.439999999999998 112.995 -161.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 80.93 29.66 41.33 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.637 -0.664 . . . . 61.509999999999998 112.398 -170.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.478 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.3 mt -76.34 -44.85 34.81 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-N 117.848 0.824 . . . . 73.120000000000005 109.411 173.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.3 m -144.96 149.38 16.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 118.256 0.48 . . . . 73.340000000000003 110.953 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.39 147.18 38.21 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.674 -0.861 . . . . 74.140000000000001 108.674 160.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -62.66 -43.62 98.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.944 -0.472 . . . . 74.430000000000007 110.161 171.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.6 m -79.89 19.56 0.68 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.085 0.772 . . . . 75.329999999999998 113.085 172.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.93 -42.47 48.72 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 120.319 1.418 . . . . 75.219999999999999 108.758 157.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -62.45 131.56 49.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.733 0.813 . . . . 71.340000000000003 110.054 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.86 170.1 10.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.719 1.207 . . . . 74.400000000000006 109.712 169.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.07 -30.56 62.16 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.046 1.338 . . . . 75.310000000000002 112.307 -173.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.48 -37.36 78.03 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.369 0.668 . . . . 63.409999999999997 110.928 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.82 34.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.632 0.773 . . . . 42.409999999999997 111.125 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.8 mm -58.71 -49.06 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.683 0.793 . . . . 72.540000000000006 109.183 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -55.63 -56.7 17.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.154 1.382 . . . . 61.229999999999997 109.76 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.56 75.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.724 0.809 . . . . 61.539999999999999 111.774 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mt -57.86 -38.01 74.92 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 113.007 0.743 . . . . 74.439999999999998 113.007 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.94 -32.89 74.82 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.566 0.621 . . . . 63.439999999999998 111.506 174.31 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -73.73 -15.6 61.21 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.006 0.743 . . . . 63.409999999999997 113.006 -171.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -89.18 132.85 34.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 119.076 0.853 . . . . 75.319999999999993 110.502 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -65.03 175.33 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.263 -1.335 . . . . 73.519999999999996 111.749 166.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -48.32 -64.07 0.9 Allowed 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.935 2.094 . . . . 74.519999999999996 111.788 -176.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.71 -36.69 57.03 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 122.831 0.452 . . . . 60.25 110.887 -175.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.61 -36.33 93.21 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 111.182 -0.767 . . . . 34.229999999999997 111.182 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.78 61.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.168 0.987 . . . . 53.020000000000003 109.911 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.09 -39.02 77.53 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.204 0.456 . . . . 75.25 110.286 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.42 91.89 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.292 0.637 . . . . 35.229999999999997 111.762 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -54.31 -44.35 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 109.42 -0.585 . . . . 75.120000000000005 109.42 173.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.546 HD21 HD12 ' A' ' 21' ' ' LEU . 19.9 mt -70.28 -47.05 62.94 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.339 -0.986 . . . . 72.409999999999997 108.339 -169.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -56.58 -56.17 24.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.46 1.504 . . . . 64.129999999999995 110.242 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -62.58 -41.0 98.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.408 1.099 . . . . 73.099999999999994 109.66 -174.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.66 -49.68 75.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 125.184 1.394 . . . . 75.420000000000002 110.797 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.478 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -71.39 -28.89 64.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.965 -1.084 . . . . 72.310000000000002 113.415 -179.235 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -75.73 -1.09 23.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.253 0.621 . . . . 72.219999999999999 111.463 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 m -83.77 172.05 12.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.585 1.539 . . . . 72.0 109.63 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -117.48 91.37 3.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.21 1.004 . . . . 71.329999999999998 110.301 -171.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.9 mt -79.99 -2.81 45.69 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.081 0.952 . . . . 62.32 113.417 -166.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.7 t -47.96 -60.92 2.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.174 1.79 . . . . 45.399999999999999 110.56 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -88.05 31.15 0.8 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.294 1.038 . . . . 73.319999999999993 111.899 -172.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -123.03 120.75 61.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 106.77 -1.567 . . . . 74.340000000000003 106.77 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -73.05 -51.01 19.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.874 0.87 . . . . 71.340000000000003 109.23 175.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -106.71 80.97 1.51 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 127.192 2.197 . . . . 72.530000000000001 108.195 -160.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -51.76 -37.4 51.15 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.262 -1.336 . . . . 74.239999999999995 111.251 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.9 p -64.08 -56.4 15.22 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 124.203 1.001 . . . . 73.239999999999995 109.824 -173.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.77 -36.34 72.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.33 0.652 . . . . 53.299999999999997 111.053 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.26 -53.82 46.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.69 -0.804 . . . . 71.099999999999994 109.499 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.59 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -60.47 -53.84 52.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.338 1.455 . . . . 44.240000000000002 109.598 -175.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.424 ' N ' HD13 ' A' ' 73' ' ' LEU . 8.1 t -62.0 -31.64 72.03 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.009 -0.996 . . . . 60.420000000000002 110.105 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.0 -49.22 68.31 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 118.932 -0.926 . . . . 62.340000000000003 111.411 169.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -59.18 -47.08 91.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 118.517 1.159 . . . . 63.200000000000003 109.527 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.59 ' CE ' HD11 ' A' ' 73' ' ' LEU . 35.3 mtt -53.41 -47.5 69.53 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.69 -0.631 . . . . 74.129999999999995 110.53 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -58.8 -45.48 89.8 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.838 -0.601 . . . . 75.530000000000001 110.049 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -47.05 86.79 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.852 0.751 . . . . 62.109999999999999 110.556 174.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -60.3 -42.94 96.58 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 113.056 0.762 . . . . 75.420000000000002 113.056 -177.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -69.02 -11.01 60.4 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.815 0.734 . . . . 72.519999999999996 111.339 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -134.69 74.33 1.52 Allowed 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 125.427 1.491 . . . . 73.510000000000005 110.107 -175.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -117.37 90.7 3.39 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.265 -1.013 . . . . 74.439999999999998 108.265 165.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -123.77 156.0 36.87 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.306 1.042 . . . . 62.119999999999997 108.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? . . . . . 0 C--O 1.25 1.101 0 C-N-CA 125.515 1.526 . . . . 73.340000000000003 109.31 -179.484 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.563 0 CA-C-O 121.253 0.363 . . . . 54.310000000000002 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.86 -173.95 4.87 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.575 1.95 . . . . 64.129999999999995 109.276 163.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.1 pm0 -77.33 -26.32 51.98 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 120.733 -1.229 . . . . 55.450000000000003 112.918 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -58.47 -20.49 45.78 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.281 0.946 . . . . 63.119999999999997 113.16 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -48.61 -46.89 40.18 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.526 1.131 . . . . 75.239999999999995 112.266 -176.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -65.99 -40.06 90.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.876 0.47 . . . . 75.129999999999995 111.5 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.2 m -59.9 -37.93 80.82 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.986 0.914 . . . . 75.439999999999998 110.31 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -72.27 -44.16 63.21 Favored 'General case' 0 CA--C 1.52 -0.194 0 C-N-CA 123.947 0.899 . . . . 52.25 111.253 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.67 -26.35 44.22 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.787 0.835 . . . . 62.009999999999998 111.351 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.96 -17.79 39.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.783 0.833 . . . . 74.430000000000007 112.632 -178.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.04 19.78 5.44 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.255 1.422 . . . . 73.219999999999999 113.72 -161.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.95 23.8 75.48 Favored Glycine 0 CA--C 1.525 0.667 0 O-C-N 121.577 -0.702 . . . . 54.43 112.512 -173.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.1 mt -112.06 146.17 34.28 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 124.959 1.304 . . . . 71.420000000000002 109.173 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.05 165.84 31.06 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.508 2.139 . . . . 62.130000000000003 111.09 177.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -60.17 -41.31 92.6 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.683 0.793 . . . . 73.450000000000003 108.891 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -58.02 -44.69 87.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.446 -0.797 . . . . 74.439999999999998 111.718 -171.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.4 t -70.94 -48.97 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.557 -1.275 . . . . 74.25 107.557 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.54 67.85 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.106 0.78 . . . . 72.25 113.106 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -50.35 -41.04 50.88 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.333 1.453 . . . . 75.140000000000001 113.893 172.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.52 -24.28 19.69 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 118.507 -0.759 . . . . 74.209999999999994 112.165 177.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.01 -34.52 43.93 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 118.962 0.801 . . . . 73.219999999999999 111.088 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -57.09 -41.35 78.71 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.872 0.844 . . . . 73.049999999999997 111.164 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -27.71 52.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 127.886 2.474 . . . . 74.219999999999999 112.446 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.464 HD13 ' HE3' ' A' ' 59' ' ' LYS . 23.3 mm -71.51 -37.3 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 N-CA-C 107.726 -1.213 . . . . 71.030000000000001 107.726 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -83.03 -10.52 58.7 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.454 1.102 . . . . 75.019999999999996 112.471 -176.125 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.3 t -73.77 -42.73 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 O-C-N 121.213 -0.929 . . . . 63.020000000000003 109.803 171.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.88 37.1 2.64 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.726 0.81 . . . . 53.539999999999999 112.152 -144.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.01 18.63 57.74 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 124.954 1.264 . . . . 74.340000000000003 115.085 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.2 mt -85.12 -65.78 0.97 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.348 1.074 . . . . 71.010000000000005 109.165 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.3 m -139.39 166.54 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.823 1.249 . . . . 74.230000000000004 110.369 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.49 162.93 12.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.234 1.413 . . . . 51.409999999999997 108.558 156.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -58.32 -35.36 71.76 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.847 0.748 . . . . 72.530000000000001 110.604 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.1 p -81.69 -5.31 57.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.537 1.135 . . . . 63.549999999999997 112.303 -174.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.61 -16.93 46.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.866 0.757 . . . . 63.409999999999997 112.471 -169.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -90.61 -175.24 4.36 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.133 1.773 . . . . 71.430000000000007 110.55 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -114.02 170.77 8.03 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.213 1.405 . . . . 72.519999999999996 109.828 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -46.57 -44.74 18.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.959 1.304 . . . . 72.409999999999997 110.608 164.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -64.49 -22.79 67.07 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.774 0.657 . . . . 62.240000000000002 112.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.28 -52.49 18.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.138 0.881 . . . . 24.530000000000001 109.902 171.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.02 -53.81 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 C-N-CA 125.144 1.377 . . . . 64.140000000000001 109.35 -175.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -64.02 -44.64 91.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.613 -0.232 . . . . 74.140000000000001 111.372 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.58 -38.52 87.83 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.178 -0.304 . . . . 75.340000000000003 110.178 -176.049 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 mt -52.59 -41.63 63.8 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.604 0.762 . . . . 75.120000000000005 111.952 173.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -59.22 -55.13 38.84 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.453 0.57 . . . . 74.420000000000002 110.081 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -74.18 -1.19 19.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 116.281 1.956 . . . . 73.310000000000002 116.281 -162.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.7 159.27 25.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.127 0.971 . . . . 74.329999999999998 110.309 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.7 p-10 -75.77 -179.65 4.9 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.185 0.994 . . . . 52.32 109.426 159.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -44.77 -70.87 0.09 Allowed 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 126.978 2.111 . . . . 75.239999999999995 110.722 171.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.26 -28.97 60.03 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 112.072 0.397 . . . . 75.049999999999997 112.072 -166.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.64 -40.44 94.04 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 110.416 -1.074 . . . . 62.450000000000003 110.416 174.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.75 -49.29 76.99 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.48 -0.771 . . . . 75.129999999999995 110.374 171.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.46 -38.85 72.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.589 1.086 . . . . 75.430000000000007 111.309 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -50.45 73.95 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.783 1.233 . . . . 71.349999999999994 111.069 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 63.2 t -52.28 -42.19 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.316 0.647 . . . . 72.25 110.141 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -71.49 -45.64 61.95 Favored 'General case' 0 CA--C 1.516 -0.345 0 O-C-N 122.345 -0.222 . . . . 60.329999999999998 110.414 -169.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -54.05 -56.86 14.01 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.88 1.272 . . . . 64.010000000000005 108.935 173.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -70.56 -6.68 38.26 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.099 0.777 . . . . 74.239999999999995 113.099 -168.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -93.87 -38.91 10.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.027 1.731 . . . . 74.150000000000006 111.701 174.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE3' HD13 ' A' ' 24' ' ' ILE . 4.9 mmtt -60.49 -35.27 75.53 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.64 1.109 . . . . 75.25 109.579 165.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -79.46 46.51 0.75 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.904 1.682 . . . . 64.019999999999996 109.077 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.2 m -153.76 167.07 30.84 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.304 -1.498 . . . . 74.420000000000002 111.705 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -99.78 116.33 31.62 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 126.529 1.932 . . . . 72.409999999999997 106.416 175.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.8 mt -114.03 8.7 17.16 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 126.589 1.956 . . . . 53.350000000000001 109.92 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 m -75.27 -58.82 3.05 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 126.978 2.111 . . . . 75.239999999999995 108.775 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -78.03 0.67 23.64 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 113.34 0.867 . . . . 75.349999999999994 113.34 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 48.9 t -82.7 141.25 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 120.937 -1.102 . . . . 60.140000000000001 109.819 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -69.13 0.54 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.428 1.491 . . . . 35.43 110.282 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -111.42 100.93 9.43 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 127.34 2.256 . . . . 73.450000000000003 107.912 -163.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -60.64 -31.98 71.17 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.495 1.118 . . . . 73.120000000000005 112.83 -165.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -57.0 -49.17 76.6 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.848 1.659 . . . . 74.150000000000006 108.757 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.12 -5.63 36.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 113.458 0.91 . . . . 20.329999999999998 113.458 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -91.0 -56.33 3.21 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 119.872 -0.731 . . . . 72.409999999999997 109.38 163.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.678 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -62.26 -50.8 70.27 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 126.117 1.767 . . . . 52.32 109.674 -165.555 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.7 t -55.09 -36.16 65.36 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.239 -1.346 . . . . 71.230000000000004 109.473 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.95 -42.04 97.06 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.002 -0.888 . . . . 73.140000000000001 112.7 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.7 t -60.53 -46.35 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 119.097 1.449 . . . . 54.219999999999999 108.653 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.678 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -58.54 -40.44 83.02 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.604 -0.685 . . . . 74.150000000000006 109.995 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -53.75 54.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.485 -0.769 . . . . 61.310000000000002 110.963 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -63.05 -42.94 99.84 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.7 -0.667 . . . . 63.25 109.788 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -60.09 -38.04 81.76 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.742 1.61 . . . . 75.040000000000006 112.523 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -21.33 59.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.592 0.757 . . . . 72.450000000000003 110.242 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -134.44 60.2 1.71 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.263 1.825 . . . . 72.349999999999994 111.423 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.48 -0.79 27.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.797 1.239 . . . . 73.140000000000001 112.249 177.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -62.93 108.27 1.17 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 107.465 -1.309 . . . . 63.549999999999997 107.465 164.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.493 ' HA ' ' HD3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.885 0 C-N-CA 126.671 1.988 . . . . 73.510000000000005 105.705 165.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.794 0 N-CA-C 111.384 -0.686 . . . . 72.0 111.384 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -96.36 -167.77 1.63 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.552 1.141 . . . . 75.420000000000002 110.28 166.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.07 -33.22 51.07 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 125.773 1.629 . . . . 71.109999999999999 113.264 -175.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.95 -41.93 97.24 Favored 'General case' 0 C--O 1.227 -0.114 0 C-N-CA 124.797 1.239 . . . . 64.439999999999998 110.168 -179.168 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -45.94 -60.93 1.97 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.945 1.698 . . . . 75.140000000000001 112.754 -170.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -63.38 -33.41 75.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.223 -0.417 . . . . 41.240000000000002 111.494 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.15 -39.61 86.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.462 -0.78 . . . . 73.230000000000004 109.364 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.12 96.07 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 120.011 1.278 . . . . 72.400000000000006 109.71 174.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.26 -16.81 61.44 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.996 0.918 . . . . 71.239999999999995 112.879 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -105.71 -17.79 14.28 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.26 1.824 . . . . 64.0 110.767 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.32 30.29 0.71 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 127.507 2.323 . . . . 74.400000000000006 110.813 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.455 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 82.38 3.2 90.63 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-O 117.784 -1.564 . . . . 71.099999999999994 114.277 173.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.2 mt -104.29 157.24 34.48 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.939 1.87 . . . . 42.420000000000002 112.92 -172.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.67 170.58 19.9 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 124.346 3.364 . . . . 63.299999999999997 113.739 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -66.4 -47.63 72.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 124.985 1.314 . . . . 55.130000000000003 109.728 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -42.52 86.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.16 0.43 . . . . 72.230000000000004 112.16 -166.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.93 -57.12 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 126.791 2.036 . . . . 63.109999999999999 107.285 173.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.14 -42.69 63.56 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 124.659 1.184 . . . . 73.140000000000001 112.491 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.11 -45.55 71.9 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.04 0.936 . . . . 74.329999999999998 110.217 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -38.54 28.07 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 119.289 -0.386 . . . . 75.439999999999998 110.6 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.33 -41.38 94.0 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.736 1.215 . . . . 75.019999999999996 110.88 -174.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.23 -44.31 75.34 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.885 1.274 . . . . 75.310000000000002 110.547 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -33.36 67.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.453 1.101 . . . . 73.439999999999998 112.858 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -66.93 -25.25 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.78 0.832 . . . . 64.329999999999998 109.483 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.68 -31.84 14.29 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.08 0.952 . . . . 73.409999999999997 111.855 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -53.19 -53.47 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.475 0.71 . . . . 74.400000000000006 110.883 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 1.75 17.13 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.755 0.65 . . . . 63.119999999999997 112.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.08 25.88 72.27 Favored Glycine 0 CA--C 1.528 0.885 0 O-C-N 120.782 -1.199 . . . . 54.539999999999999 112.88 174.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.469 HD13 ' HE2' ' A' ' 59' ' ' LYS . 1.8 mp -59.88 -43.88 94.5 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.203 1.501 . . . . 75.140000000000001 108.067 168.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -132.01 168.63 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 126.278 1.831 . . . . 75.239999999999995 108.224 167.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.97 161.29 13.81 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 107.862 -1.162 . . . . 73.200000000000003 107.862 165.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -59.28 -10.22 2.84 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.095 1.517 . . . . 75.230000000000004 115.095 -172.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.69 42.86 3.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.101 1.76 . . . . 63.299999999999997 109.73 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -74.47 -10.15 59.28 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 127.793 2.437 . . . . 64.239999999999995 113.647 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 mt -101.24 158.56 15.95 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 122.958 0.503 . . . . 71.340000000000003 112.142 -167.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -91.2 163.2 14.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.999 1.32 . . . . 74.030000000000001 109.351 167.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -46.99 -51.94 15.93 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.188 2.195 . . . . 71.420000000000002 111.784 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -76.79 -9.27 58.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.362 -0.828 . . . . 75.340000000000003 111.353 -172.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.26 -47.59 41.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.197 -1.382 . . . . 73.420000000000002 109.387 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.72 -52.09 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 120.597 1.544 . . . . 45.5 109.901 174.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.91 -40.44 88.82 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.969 0.729 . . . . 64.0 112.969 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.2 -23.24 54.65 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.502 1.046 . . . . 72.230000000000004 112.67 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.88 -32.03 73.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.16 0.984 . . . . 74.0 110.415 171.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.455 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 1.0 OUTLIER -62.13 -13.18 24.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.819 1.247 . . . . 72.0 112.89 174.13 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -104.85 2.99 30.54 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.047 0.939 . . . . 65.329999999999998 112.852 -171.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -97.47 160.25 14.44 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 120.626 -1.297 . . . . 63.240000000000002 109.98 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -86.73 178.4 7.03 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.349 1.46 . . . . 73.140000000000001 110.107 164.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -52.35 -68.04 0.2 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 127.275 2.23 . . . . 64.230000000000004 110.153 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.02 -34.0 77.08 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.92 -0.488 . . . . 75.120000000000005 111.781 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.456 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -61.39 -59.5 9.81 Favored Glycine 0 C--N 1.34 0.763 0 N-CA-C 109.616 -1.394 . . . . 52.240000000000002 109.616 177.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.86 -45.26 63.99 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.514 0.726 . . . . 71.310000000000002 111.891 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.63 -37.35 81.17 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.903 0.774 . . . . 74.409999999999997 111.761 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.91 -46.39 74.99 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.561 0.619 . . . . 73.109999999999999 110.321 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.521 HG22 ' CD2' ' A' ' 80' ' ' TYR . 10.2 t -57.62 -40.78 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 118.608 0.64 . . . . 73.019999999999996 110.747 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.99 -49.07 77.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.421 1.088 . . . . 75.400000000000006 109.824 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -57.53 -52.0 67.2 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.373 -0.83 . . . . 63.329999999999998 109.107 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -69.83 -26.21 64.12 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.425 0.557 . . . . 74.340000000000003 111.633 -170.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -62.14 -67.66 0.39 Allowed 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.951 -1.129 . . . . 73.0 107.951 168.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.469 ' HE2' HD13 ' A' ' 29' ' ' LEU . 4.4 tppp? -48.8 -37.28 18.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.192 0.997 . . . . 71.140000000000001 111.583 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -72.75 28.14 0.06 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.229 1.411 . . . . 60.130000000000003 112.935 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.8 m -142.27 157.84 44.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.733 1.613 . . . . 54.539999999999999 108.989 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.16 79.49 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 124.364 2.03 . . . . 72.329999999999998 108.423 -153.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.406 ' O ' ' HE2' ' A' ' 69' ' ' LYS . 70.0 mt -72.57 -0.2 12.19 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 127.24 2.216 . . . . 74.409999999999997 115.187 -165.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.4 t -56.4 -45.6 80.56 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.8 1.182 . . . . 74.430000000000007 111.368 -163.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -106.44 64.08 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.687 -0.857 . . . . 71.0 108.687 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.1 t -131.73 124.92 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 N-CA-C 106.87 -1.53 . . . . 53.329999999999998 106.87 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.513 ' CD ' ' H ' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -65.24 -54.27 31.8 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.686 0.794 . . . . 72.239999999999995 109.134 178.333 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -115.18 71.88 0.78 Allowed 'General case' 0 C--N 1.335 -0.065 0 C-N-CA 125.669 1.587 . . . . 75.319999999999993 110.741 -156.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HE2' ' O ' ' A' ' 63' ' ' LEU . 30.1 mmtp -46.95 -36.8 8.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 127.02 2.128 . . . . 64.109999999999999 112.916 178.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.31 -50.53 67.47 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 125.329 1.452 . . . . 62.039999999999999 111.077 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.9 71.93 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.967 0.507 . . . . 61.039999999999999 110.569 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -57.29 -54.96 40.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.625 -0.88 . . . . 72.200000000000003 108.625 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.41 -46.92 87.34 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.699 0.4 . . . . 75.140000000000001 110.532 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 33.1 t -53.55 -41.82 66.85 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.651 0.78 . . . . 54.229999999999997 110.856 177.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.58 -53.41 43.84 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.969 -0.853 . . . . 73.420000000000002 110.969 176.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -57.29 -45.38 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 123.222 0.609 . . . . 63.32 109.386 177.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.3 mtt -55.78 -44.33 77.63 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.969 -1.082 . . . . 74.409999999999997 111.717 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -57.16 -53.59 56.41 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 118.792 -0.623 . . . . 71.109999999999999 109.453 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 m -58.68 -43.26 89.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.351 0.407 . . . . 55.310000000000002 110.848 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.521 ' CD2' HG22 ' A' ' 54' ' ' VAL . 14.4 m-85 -61.92 -38.49 88.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.959 -1.088 . . . . 74.040000000000006 112.463 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.72 -11.58 59.84 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.711 -1.243 . . . . 74.019999999999996 112.438 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -144.79 90.63 2.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 124.815 1.246 . . . . 61.229999999999997 109.481 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.3 50.74 1.65 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.802 1.241 . . . . 75.109999999999999 109.568 -178.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -147.96 178.55 8.42 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.096 2.158 . . . . 73.299999999999997 107.609 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 tptt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.631 1.572 . . . . 62.409999999999997 109.502 174.681 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 N-CA-C 109.443 -1.463 . . . . 71.150000000000006 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.65 -167.2 1.22 Allowed 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.937 -1.134 . . . . 50.25 107.937 161.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.97 -29.48 70.84 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.714 1.606 . . . . 74.310000000000002 112.348 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.46 -36.75 76.56 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.105 0.866 . . . . 73.540000000000006 110.264 -171.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -44.39 -53.4 6.86 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.495 1.918 . . . . 74.25 112.495 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.6 tp60 -61.88 -41.93 98.46 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 119.064 -0.493 . . . . 72.25 110.844 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.0 m -67.0 -37.28 83.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.539 -0.541 . . . . 64.140000000000001 109.539 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -36.75 82.44 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.281 -0.887 . . . . 63.229999999999997 111.295 176.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -23.33 67.22 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.365 0.53 . . . . 64.430000000000007 111.084 176.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -87.85 -24.28 23.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.962 0.801 . . . . 72.239999999999995 112.08 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.38 11.99 1.38 Allowed 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.101 2.161 . . . . 54.43 112.724 -164.486 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 16.12 46.29 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-O 117.954 -1.47 . . . . 71.239999999999995 114.168 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.7 mt -119.79 157.02 53.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.773 1.286 . . . . 71.450000000000003 113.184 -171.228 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.23 172.49 15.95 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 124.657 3.571 . . . . 72.519999999999996 113.178 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -73.45 -43.72 59.72 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.972 1.309 . . . . 74.239999999999995 110.278 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.91 -38.48 72.91 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.992 -0.283 . . . . 71.239999999999995 111.611 -171.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.3 t -70.74 -52.31 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 127.227 2.211 . . . . 73.340000000000003 107.146 176.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.02 -42.25 62.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.889 1.275 . . . . 70.120000000000005 112.112 -173.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -52.79 -55.04 25.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 73.530000000000001 110.39 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.55 -27.26 58.58 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 118.568 -0.73 . . . . 74.319999999999993 111.308 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.3 tp -74.69 -41.63 59.9 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.001 0.92 . . . . 62.329999999999998 110.994 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -54.65 -45.97 73.89 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.06 0.944 . . . . 73.530000000000001 110.121 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -37.57 28.6 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 126.999 2.12 . . . . 63.439999999999998 112.403 176.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.41 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 108.688 -0.856 . . . . 72.109999999999999 108.688 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 19.7 m-85 -80.98 -4.03 53.67 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.884 1.274 . . . . 74.129999999999995 112.74 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 42.2 t -85.42 -44.49 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.787 1.176 . . . . 75.549999999999997 110.752 175.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.83 -4.29 42.84 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.1 0.778 . . . . 72.530000000000001 113.1 -162.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.12 -14.84 64.55 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 125.202 1.382 . . . . 62.240000000000002 113.179 -176.33 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.427 HD12 ' HE2' ' A' ' 59' ' ' LYS . 87.9 mt -53.47 -51.66 62.02 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.681 1.593 . . . . 61.420000000000002 110.951 -172.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 69' ' ' LYS . 5.8 m -136.47 160.09 37.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 O-C-N 123.532 0.52 . . . . 63.25 111.899 168.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.46 159.68 20.72 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 108.504 -0.924 . . . . 74.430000000000007 108.504 156.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.426 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 29.1 p80 -59.97 -31.44 69.9 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.934 -0.555 . . . . 61.43 112.088 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.74 2.05 55.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.373 -0.823 . . . . 73.120000000000005 112.331 179.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -77.34 15.04 0.81 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.583 1.538 . . . . 54.310000000000002 112.694 -177.011 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 51.3 mt -118.09 -170.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.43 2.692 . . . . 74.150000000000006 106.747 -174.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -132.55 172.63 12.25 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 107.48 -1.304 . . . . 74.409999999999997 107.48 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -52.76 -36.61 58.22 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.668 0.787 . . . . 63.240000000000002 110.825 171.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -54.63 -32.09 58.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.689 -0.632 . . . . 72.510000000000005 112.37 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.77 -46.01 22.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.565 0.746 . . . . 61.329999999999998 110.963 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.1 mm -55.23 -53.16 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 N-CA-C 107.97 -1.122 . . . . 74.549999999999997 107.97 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.43 -45.16 95.49 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 125.102 1.361 . . . . 74.510000000000005 110.336 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.58 84.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.329 -0.843 . . . . 74.549999999999997 111.918 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.33 -38.83 81.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.239 0.927 . . . . 73.230000000000004 111.533 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -61.09 -44.87 96.7 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.145 0.429 . . . . 65.25 109.942 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -69.3 11.99 0.2 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 128.921 2.888 . . . . 73.140000000000001 116.1 -165.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -118.33 154.27 32.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.858 1.263 . . . . 62.140000000000001 109.55 -175.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.18 176.9 0.1 Allowed 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 122.887 1.327 . . . . 63.100000000000001 112.141 155.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -52.23 -65.71 0.51 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.958 2.503 . . . . 70.219999999999999 110.313 165.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -32.97 66.51 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.369 0.986 . . . . 50.450000000000003 111.973 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.08 -57.24 10.29 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.34 0.971 . . . . 53.25 111.023 168.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.45 -42.87 97.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.659 -0.686 . . . . 74.420000000000002 111.297 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.86 -50.26 69.51 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 117.733 -1.127 . . . . 71.540000000000006 110.728 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.28 -45.91 69.08 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.632 1.106 . . . . 61.140000000000001 111.534 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.41 HG11 ' HG2' ' A' ' 77' ' ' MET . 55.7 t -53.87 -43.12 56.0 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 124.507 1.123 . . . . 74.310000000000002 111.556 175.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -72.17 -42.53 65.8 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 122.985 0.514 . . . . 71.439999999999998 109.994 -175.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -71.25 -41.09 70.56 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 122.49 0.316 . . . . 75.129999999999995 110.834 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -69.31 -17.62 63.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.404 -0.518 . . . . 62.409999999999997 111.157 173.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.477 ' CD2' HD23 ' A' ' 73' ' ' LEU . 16.6 t80 -84.95 -41.45 15.89 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-O 119.418 -0.325 . . . . 70.530000000000001 110.324 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.427 ' HE2' HD12 ' A' ' 29' ' ' LEU . 6.6 ttmt -70.91 -19.92 62.54 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.881 0.764 . . . . 75.450000000000003 111.362 172.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -75.49 48.23 0.43 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.301 1.44 . . . . 71.340000000000003 109.753 168.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.4 m -149.58 152.55 35.67 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.629 -1.919 . . . . 71.519999999999996 112.411 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -93.37 78.55 4.43 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.271 1.428 . . . . 63.43 107.498 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -79.96 -11.86 59.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.181 -0.918 . . . . 74.219999999999999 111.064 -168.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 m -53.1 -30.99 39.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.862 2.065 . . . . 75.219999999999999 112.07 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.7 m80 -100.21 14.01 32.31 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.352 1.061 . . . . 64.340000000000003 113.862 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.2 t -105.17 135.14 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 121.574 -0.704 . . . . 52.149999999999999 109.841 -176.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -68.48 0.32 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.37 1.868 . . . . 61.25 110.534 176.046 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -111.61 88.92 2.92 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.34 1.456 . . . . 63.450000000000003 109.692 -166.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB3' HG12 ' A' ' 30' ' ' VAL . 38.9 mmtm -53.21 -31.6 43.87 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.195 1.398 . . . . 71.439999999999998 114.07 -172.746 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.53 25.92 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 128.473 2.709 . . . . 72.150000000000006 109.085 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.12 89.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.495 0.718 . . . . 73.230000000000004 110.146 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.97 -51.03 69.71 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.33 -0.619 . . . . 63.520000000000003 109.33 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.561 HD21 ' HE3' ' A' ' 77' ' ' MET . 0.2 OUTLIER -62.05 -57.57 11.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.473 1.109 . . . . 70.120000000000005 108.622 -175.766 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 2.8 t -62.22 -27.1 68.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.637 -0.71 . . . . 52.43 110.583 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.07 -53.69 40.71 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.855 0.741 . . . . 72.140000000000001 111.405 168.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -54.52 -49.26 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 118.285 1.042 . . . . 74.439999999999998 108.545 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.561 ' HE3' HD21 ' A' ' 73' ' ' LEU . 18.2 mtt -50.59 -54.04 25.82 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.617 0.767 . . . . 73.409999999999997 110.744 177.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -62.56 -43.99 97.44 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.802 -0.444 . . . . 74.549999999999997 109.802 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -58.6 -47.5 84.12 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.397 0.679 . . . . 70.219999999999999 109.607 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -64.06 -44.01 93.74 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.342 0.519 . . . . 74.530000000000001 111.924 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -62.44 -50.74 70.26 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.054 -0.721 . . . . 73.340000000000003 109.054 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.37 67.88 10.02 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 122.836 1.303 . . . . 72.299999999999997 110.011 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -105.24 76.11 1.21 Allowed 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.949 -1.13 . . . . 74.319999999999993 107.949 160.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -122.73 88.16 2.88 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 102.765 -3.05 . . . . 70.129999999999995 102.765 162.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptt . . . . . 0 C--O 1.261 1.693 0 C-N-CA 128.276 2.631 . . . . 74.519999999999996 107.47 -169.752 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.88 0 N-CA-C 109.959 -1.256 . . . . 73.530000000000001 109.959 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.34 -176.61 3.03 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.919 1.288 . . . . 72.120000000000005 109.588 -168.117 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -50.99 -37.48 45.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.442 1.097 . . . . 74.230000000000004 112.459 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -35.27 76.3 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.56 -0.904 . . . . 62.140000000000001 108.56 -168.115 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -44.08 -53.39 6.42 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.896 1.678 . . . . 72.530000000000001 111.541 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -66.58 -43.5 84.79 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.861 -0.336 . . . . 61.420000000000002 110.664 -175.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.5 m -61.65 -38.59 88.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.25 0.62 . . . . 73.230000000000004 109.882 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.85 78.63 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.656 1.583 . . . . 55.32 111.692 178.219 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.88 -25.49 65.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.344 0.975 . . . . 64.120000000000005 110.135 173.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.89 -11.59 26.47 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.411 1.005 . . . . 73.010000000000005 111.905 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.15 13.03 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.829 -1.17 . . . . 74.219999999999999 112.184 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 106.36 1.89 38.08 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 124.49 1.043 . . . . 51.420000000000002 113.622 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.1 mt -100.17 144.84 29.17 Favored Pre-proline 0 N--CA 1.448 -0.563 0 C-N-CA 124.013 0.925 . . . . 74.510000000000005 108.688 -160.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' HG23 ' A' ' 17' ' ' VAL . 73.9 Cg_endo -69.61 164.23 35.16 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 121.639 1.559 . . . . 71.239999999999995 110.496 176.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -62.46 -46.81 86.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.28 -1.007 . . . . 74.200000000000003 108.28 -178.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -36.91 71.0 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 114.219 1.192 . . . . 75.340000000000003 114.219 -174.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . 0.402 HG23 ' HG2' ' A' ' 14' ' ' PRO . 57.4 t -73.96 -52.47 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 107.049 -1.463 . . . . 72.200000000000003 107.049 174.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.2 -36.09 51.02 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.381 1.073 . . . . 52.210000000000001 112.589 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.62 -56.18 15.05 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.531 0.733 . . . . 62.200000000000003 110.738 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.81 -32.88 57.93 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 115.839 -0.618 . . . . 71.329999999999998 110.389 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.54 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -71.58 -32.25 67.85 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.451 1.1 . . . . 62.549999999999997 111.185 -174.401 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.59 -45.17 85.61 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.006 1.322 . . . . 75.439999999999998 111.567 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -27.45 66.66 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.473 1.109 . . . . 75.409999999999997 112.975 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.77 -17.23 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.66 -0.65 . . . . 75.540000000000006 109.509 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.54 ' HE2' HD23 ' A' ' 21' ' ' LEU . 64.7 m-85 -97.99 -0.96 43.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.644 1.178 . . . . 75.319999999999993 113.227 175.38 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.0 t -84.1 -55.6 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.191 -0.943 . . . . 75.230000000000004 109.078 175.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.06 36.42 1.21 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.513 1.525 . . . . 61.119999999999997 111.469 -151.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 59.28 27.95 63.7 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.378 1.466 . . . . 63.119999999999997 115.156 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.437 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 38.5 mt -85.44 -66.02 0.95 Allowed 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.789 0.836 . . . . 74.540000000000006 109.207 176.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.99 161.73 35.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.078 0.551 . . . . 60.409999999999997 110.789 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.25 158.6 15.51 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.644 2.378 . . . . 60.140000000000001 109.588 158.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -58.17 -31.94 67.73 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.204 0.456 . . . . 75.230000000000004 111.911 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.4 t -95.21 10.32 36.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.563 0.745 . . . . 63.229999999999997 111.959 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -83.03 -12.12 57.49 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 120.679 -1.263 . . . . 74.420000000000002 111.193 169.261 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.98 179.4 5.97 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.964 2.106 . . . . 51.219999999999999 109.91 174.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 p30 -139.34 -175.92 4.35 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.526 1.13 . . . . 62.130000000000003 110.373 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -55.73 -36.48 67.3 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.388 -0.82 . . . . 75.019999999999996 111.642 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.0 mtm-85 -66.73 -18.71 65.51 Favored 'General case' 0 C--N 1.338 0.076 0 CA-C-O 118.859 -0.591 . . . . 75.150000000000006 111.294 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.72 -51.92 11.64 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.491 1.042 . . . . 53.119999999999997 109.93 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.4 mm -60.8 -50.44 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.225 1.41 . . . . 75.129999999999995 110.372 -173.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.22 -44.07 76.55 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.626 -0.509 . . . . 74.239999999999995 109.626 -174.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.88 82.04 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 122.761 0.424 . . . . 64.200000000000003 111.748 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.42 -45.86 80.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.466 0.575 . . . . 71.450000000000003 111.259 178.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -20.61 66.14 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.098 -0.953 . . . . 73.120000000000005 111.733 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' CD ' HH21 ' A' ' 81' ' ' ARG . 2.1 mt-10 -85.42 43.7 1.04 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.423 1.465 . . . . 71.409999999999997 111.876 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -139.79 156.32 46.82 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.961 -1.087 . . . . 73.200000000000003 110.053 170.081 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -84.99 178.13 7.69 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.547 0.739 . . . . 71.439999999999998 109.947 165.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -49.41 -56.39 9.81 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.088 1.755 . . . . 71.409999999999997 112.04 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -81.41 -34.1 31.78 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.028 -0.42 . . . . 71.420000000000002 111.625 -172.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.48 87.07 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 111.544 -0.622 . . . . 71.209999999999994 111.544 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.96 69.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.947 1.299 . . . . 73.540000000000006 109.567 168.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.8 mt -63.52 -35.27 79.93 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 118.061 -0.971 . . . . 75.109999999999999 111.502 -178.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.38 87.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.527 1.058 . . . . 35.509999999999998 110.853 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -54.66 -41.64 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 121.618 -0.677 . . . . 64.439999999999998 110.444 173.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.7 mt -78.27 -33.19 49.74 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.403 -0.811 . . . . 75.310000000000002 110.45 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -54.89 -62.5 1.61 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 107.228 -1.397 . . . . 75.340000000000003 107.228 167.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -72.97 -10.06 59.4 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.471 0.915 . . . . 74.420000000000002 113.471 -164.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -84.18 -61.31 1.84 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.867 0.867 . . . . 60.32 110.535 172.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 13.4 ttmt -63.79 -30.1 71.23 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.519 1.054 . . . . 74.230000000000004 110.573 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -81.88 57.51 3.48 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 124.381 1.073 . . . . 75.310000000000002 109.959 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 75.7 m -153.8 177.31 11.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.055 2.142 . . . . 73.430000000000007 107.78 161.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -115.75 105.72 13.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.827 2.051 . . . . 74.540000000000006 106.614 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.2 mt -94.59 7.25 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.049 0.939 . . . . 71.349999999999994 111.985 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.2 m -53.83 126.47 22.3 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.901 -0.777 . . . . 52.049999999999997 108.901 165.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 18.5 m80 59.39 10.26 1.75 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.447 1.899 . . . . 72.510000000000005 114.869 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.26 135.79 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 107.357 -1.349 . . . . 72.040000000000006 107.357 170.086 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -54.17 -85.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.214 1.806 . . . . 53.420000000000002 111.479 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.49 99.96 7.0 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.738 -1.578 . . . . 71.230000000000004 106.738 -162.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -62.89 -28.62 70.17 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.586 1.154 . . . . 74.049999999999997 111.232 -169.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -51.38 66.64 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.304 1.842 . . . . 52.530000000000001 109.26 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.01 -24.41 59.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.736 -0.649 . . . . 73.420000000000002 112.085 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -67.07 -56.55 9.57 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 107.053 -1.462 . . . . 64.030000000000001 107.053 171.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.689 HD11 ' HE2' ' A' ' 77' ' ' MET . 0.9 OUTLIER -55.73 -52.54 63.56 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.717 1.607 . . . . 64.439999999999998 110.118 -173.908 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 49.5 t -61.96 -28.03 69.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.559 -0.746 . . . . 61.039999999999999 110.216 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.67 -47.3 91.24 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.415 -0.803 . . . . 62.130000000000003 111.397 173.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.0 t -54.55 -53.68 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 123.944 0.898 . . . . 63.350000000000001 109.023 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.689 ' HE2' HD11 ' A' ' 73' ' ' LEU . 2.2 mtt -56.2 -50.1 72.18 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.015 0.526 . . . . 75.040000000000006 110.97 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -54.22 -51.0 65.85 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.649 -0.5 . . . . 75.010000000000005 109.649 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -54.59 -48.5 72.08 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 124.514 1.134 . . . . 72.430000000000007 109.897 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -64.21 -44.11 92.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.183 0.901 . . . . 75.230000000000004 112.55 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.432 HH21 ' CD ' ' A' ' 45' ' ' GLU . 3.9 ttt-85 -70.79 -19.42 62.69 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.186 0.903 . . . . 75.209999999999994 111.457 178.511 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -129.96 65.68 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 122.823 1.297 . . . . 73.109999999999999 108.944 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 21.7 ptt85 -99.25 5.24 46.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.51 -1.223 . . . . 75.409999999999997 112.447 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -83.15 30.59 0.45 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.481 1.513 . . . . 74.439999999999998 112.55 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 85' ' ' LYS . 6.6 tppt? . . . . . 0 C--O 1.246 0.913 0 C-N-CA 126.686 1.995 . . . . 64.209999999999994 107.637 -166.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.449 0 N-CA-C 110.595 -1.002 . . . . 61.539999999999999 110.595 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -137.11 -167.87 2.18 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.544 -0.539 . . . . 63.530000000000001 109.544 -173.161 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.04 23.52 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.606 -1.309 . . . . 50.43 114.32 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.7 -32.97 9.11 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 127.23 2.212 . . . . 72.450000000000003 110.457 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -54.43 -59.38 4.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.516 1.127 . . . . 74.239999999999995 112.456 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 tp60 -59.42 -28.8 67.26 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.419 1.088 . . . . 74.209999999999994 111.754 -174.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -59.54 -40.52 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.0 0.92 . . . . 62.450000000000003 109.509 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.91 -39.38 87.38 Favored 'General case' 0 C--N 1.342 0.27 0 O-C-N 121.672 -0.642 . . . . 64.129999999999995 110.97 177.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 15' ' ' GLN . 3.4 mm? -64.41 -20.83 66.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.666 -0.683 . . . . 72.329999999999998 110.373 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.55 -6.02 41.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.508 1.123 . . . . 71.430000000000007 110.814 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.78 15.27 5.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 119.3 -2.125 . . . . 71.349999999999994 112.306 -175.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.94 11.84 64.68 Favored Glycine 0 CA--C 1.526 0.772 0 O-C-N 121.029 -1.044 . . . . 63.530000000000001 113.547 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.417 HD11 HD13 ' A' ' 43' ' ' LEU . 61.6 mt -116.06 160.7 34.44 Favored Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 118.861 1.331 . . . . 63.409999999999997 113.507 -161.716 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.14 172.97 12.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.463 2.775 . . . . 61.049999999999997 111.557 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.428 ' HA ' HD11 ' A' ' 9' ' ' LEU . 7.9 tt0 -70.54 -48.0 57.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 118.402 -0.809 . . . . 74.209999999999994 110.349 169.574 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -53.91 -36.1 62.37 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.271 0.841 . . . . 70.019999999999996 113.271 -163.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -70.67 -55.39 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 C-N-CA 127.889 2.475 . . . . 74.030000000000001 107.978 177.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.12 -41.09 16.83 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.83 1.252 . . . . 64.409999999999997 112.162 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -61.63 -21.52 64.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.957 1.466 . . . . 74.439999999999998 114.957 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.93 -21.23 11.24 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.568 0.543 . . . . 61.25 112.343 170.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.97 -28.11 65.27 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.214 1.006 . . . . 74.219999999999999 111.449 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -52.08 -45.83 64.94 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.292 1.437 . . . . 70.150000000000006 111.7 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -65.1 -27.98 69.13 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 127.288 2.235 . . . . 74.349999999999994 114.124 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.597 HG22 HG22 ' A' ' 30' ' ' VAL . 17.1 mm -57.48 -32.94 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.144 -0.687 . . . . 70.140000000000001 109.144 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CE1' HG23 ' A' ' 30' ' ' VAL . 68.1 m-85 -82.42 -49.92 9.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.4 1.08 . . . . 71.510000000000005 110.088 177.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.6 t -51.74 -41.83 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.495 0.718 . . . . 63.130000000000003 112.195 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.2 7.82 3.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.694 1.198 . . . . 71.120000000000005 112.113 -171.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.74 -2.27 59.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.119 0.866 . . . . 44.200000000000003 113.036 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.424 HD12 ' HE2' ' A' ' 59' ' ' LYS . 59.6 mt -66.61 -52.11 48.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 124.136 0.974 . . . . 70.310000000000002 109.353 -172.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.597 HG22 HG22 ' A' ' 24' ' ' ILE . 30.7 m -132.64 162.84 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.721 1.008 . . . . 73.109999999999999 113.721 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -99.64 155.68 17.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.412 1.485 . . . . 63.299999999999997 109.271 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -70.34 -12.55 61.66 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.466 0.913 . . . . 64.409999999999997 113.466 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.3 m -118.63 18.4 13.46 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.576 1.15 . . . . 45.020000000000003 111.916 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -68.84 -30.09 68.55 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.311 -0.868 . . . . 71.129999999999995 110.228 169.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.07 127.29 32.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.067 1.347 . . . . 73.209999999999994 108.902 -175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -83.53 164.08 20.03 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.431 -1.322 . . . . 70.400000000000006 107.431 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -44.6 -44.2 8.71 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.067 2.147 . . . . 65.0 113.263 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -51.07 -38.18 50.07 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.876 1.27 . . . . 73.099999999999994 113.368 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -84.28 -28.1 27.4 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.111 0.965 . . . . 73.319999999999993 111.604 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.0 mm -67.6 -45.24 85.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 109.493 -0.558 . . . . 51.140000000000001 109.493 176.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -57.92 -49.09 77.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 109.398 -0.593 . . . . 63.340000000000003 109.398 172.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.28 77.59 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 118.756 -0.64 . . . . 73.010000000000005 111.419 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 43' ' ' LEU . 4.9 mt -56.64 -51.54 68.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 120.197 1.362 . . . . 74.400000000000006 112.688 173.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -58.06 -17.12 15.73 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.565 0.95 . . . . 74.109999999999999 113.565 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.64 -20.63 53.49 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 120.517 1.508 . . . . 72.299999999999997 114.819 -170.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -94.95 160.93 14.36 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.168 0.985 . . . . 62.43 110.979 -168.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -85.09 178.86 7.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.915 1.286 . . . . 73.239999999999995 110.794 166.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -36.54 66.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.72 1.608 . . . . 65.219999999999999 113.628 -172.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.13 -34.34 10.79 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.269 1.427 . . . . 74.129999999999995 109.929 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.31 -43.49 97.25 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.016 -0.834 . . . . 50.539999999999999 111.016 178.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.26 81.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.874 1.27 . . . . 63.299999999999997 109.783 173.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 mp -61.96 -30.82 71.18 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.939 0.895 . . . . 74.340000000000003 111.727 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.75 82.48 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.312 0.96 . . . . 50.200000000000003 111.654 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -55.07 -41.06 57.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 109.134 -0.691 . . . . 64.420000000000002 109.134 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.55 -51.29 29.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 118.78 -0.629 . . . . 72.010000000000005 110.42 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.62 -20.72 65.9 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.038 0.535 . . . . 74.439999999999998 112.41 -174.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -87.68 -40.01 14.52 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.636 0.375 . . . . 64.230000000000004 110.937 171.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' PHE . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 73' ' ' LEU . 61.4 t80 -77.16 -36.1 55.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.554 0.946 . . . . 74.129999999999995 113.554 -173.173 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.424 ' HE2' HD12 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -58.18 -37.77 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.711 -1.243 . . . . 71.239999999999995 109.218 169.422 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -83.44 2.22 37.74 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.123 2.169 . . . . 71.099999999999994 112.112 -173.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m -82.61 152.29 25.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.622 1.201 . . . . 65.219999999999999 111.914 174.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -83.29 53.81 2.6 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.439 2.296 . . . . 73.420000000000002 109.19 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.44 -0.49 12.68 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.843 1.423 . . . . 74.120000000000005 114.843 -163.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.4 m -58.06 -59.71 4.85 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.842 1.201 . . . . 62.299999999999997 110.479 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -84.8 53.08 2.59 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.385 1.074 . . . . 65.310000000000002 110.389 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.4 t -133.23 121.06 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 106.709 -1.589 . . . . 62.030000000000001 106.709 170.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.45 -56.54 4.36 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.29 0.95 . . . . 73.430000000000007 109.612 169.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -77.05 72.82 3.62 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.02 1.328 . . . . 71.099999999999994 110.705 -172.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -57.79 -39.02 76.54 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.994 -0.441 . . . . 73.200000000000003 112.052 -176.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.87 -52.72 55.08 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 127.839 2.456 . . . . 70.219999999999999 108.457 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.29 79.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.907 -0.588 . . . . 74.340000000000003 110.843 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -62.61 -50.37 71.52 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 109.339 -0.615 . . . . 74.430000000000007 109.339 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' CE ' ' A' ' 77' ' ' MET . 1.3 tm? -59.52 -52.06 67.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.938 0.895 . . . . 65.239999999999995 109.819 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.8 t -58.36 -37.93 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.306 -0.861 . . . . 72.109999999999999 109.502 -177.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.03 -45.04 95.82 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.557 1.075 . . . . 42.200000000000003 113.167 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.47 -39.51 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 119.332 1.566 . . . . 71.409999999999997 109.587 174.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.648 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.6 mtt -62.72 -35.42 79.7 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.287 -1.508 . . . . 71.420000000000002 111.285 176.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 78' ' ' LYS . 15.3 mtpp -62.93 -46.01 89.81 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 118.461 -0.78 . . . . 65.340000000000003 111.398 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 t -62.14 -47.85 82.72 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 119.667 1.121 . . . . 71.319999999999993 108.414 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -63.81 -32.66 74.24 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.093 1.516 . . . . 73.129999999999995 115.093 -170.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -77.94 -29.55 50.02 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.969 1.259 . . . . 74.319999999999993 112.308 169.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -129.32 82.35 2.07 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.519 1.128 . . . . 74.329999999999998 109.122 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 48.2 ptt85 -131.1 26.67 4.89 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 126.763 2.025 . . . . 72.129999999999995 110.137 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -144.09 178.53 7.81 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 125.316 1.446 . . . . 65.200000000000003 109.847 -175.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt . . . . . 0 C--O 1.254 1.312 0 CA-C-O 117.111 -1.423 . . . . 70.099999999999994 110.875 161.789 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.352 0 N-CA-C 108.576 -1.81 . . . . 61.030000000000001 108.576 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 m -97.89 -170.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 123.696 0.798 . . . . 62.020000000000003 110.429 -177.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -61.53 -10.14 7.34 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 114.597 1.332 . . . . 63.5 114.597 -175.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -70.69 -43.21 69.51 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 120.305 1.412 . . . . 74.400000000000006 108.679 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -47.02 -56.84 5.74 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.65 1.58 . . . . 73.209999999999994 112.622 -173.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -59.99 -42.66 94.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.506 0.323 . . . . 73.319999999999993 110.958 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -69.83 -36.88 75.96 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 119.03 -0.51 . . . . 74.310000000000002 109.734 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -39.42 91.89 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.744 1.156 . . . . 71.319999999999993 111.493 175.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 15' ' ' GLN . 22.1 mt -63.29 -27.47 69.36 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.104 0.561 . . . . 73.109999999999999 111.131 176.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -90.94 -29.83 17.22 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.325 0.65 . . . . 75.120000000000005 110.965 177.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.68 -15.6 41.53 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.029 2.132 . . . . 60.229999999999997 111.661 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.429 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 127.04 4.93 5.86 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-O 117.411 -1.772 . . . . 74.430000000000007 114.936 167.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.9 mt -98.78 153.87 37.68 Favored Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 118.795 1.297 . . . . 73.140000000000001 111.387 -169.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.48 165.91 29.03 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.932 2.421 . . . . 64.040000000000006 111.288 171.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.515 ' HA ' HD21 ' A' ' 9' ' ' LEU . 25.9 tt0 -61.73 -40.37 94.85 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 124.463 1.105 . . . . 64.140000000000001 109.981 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -59.01 -51.29 70.71 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 123.913 0.758 . . . . 61.240000000000002 110.2 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.5 -50.71 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.904 1.282 . . . . 53.100000000000001 107.789 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.37 -41.45 76.24 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.574 0.624 . . . . 74.030000000000001 112.373 -176.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.53 -40.19 78.26 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.245 1.018 . . . . 71.409999999999997 110.865 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.89 -35.49 32.49 Favored 'General case' 0 C--O 1.231 0.089 0 O-C-N 121.828 -0.545 . . . . 42.420000000000002 110.03 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.8 tp -77.52 -36.96 51.92 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.926 -0.559 . . . . 74.400000000000006 112.313 -170.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -54.27 -40.9 68.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.773 0.715 . . . . 64.120000000000005 111.313 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -58.38 -33.72 69.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 128.32 2.648 . . . . 70.230000000000004 111.856 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.7 mm -58.78 -40.13 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 125.039 1.336 . . . . 65.340000000000003 109.728 178.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.64 -47.07 16.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.166 0.586 . . . . 73.409999999999997 109.98 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 93.1 t -53.68 -46.15 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.678 0.791 . . . . 72.329999999999998 111.174 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.74 -1.18 13.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.348 0.87 . . . . 73.120000000000005 113.348 -176.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.07 32.23 44.99 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 124.292 0.948 . . . . 21.41 112.355 171.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.59 -85.2 0.07 Allowed 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.826 -1.546 . . . . 72.010000000000005 106.826 170.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -103.2 175.92 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.441 1.096 . . . . 71.239999999999995 110.194 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.47 15.95 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.785 . . . . 63.310000000000002 111.447 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -64.43 -9.1 16.14 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.464 1.105 . . . . 61.530000000000001 113.857 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.1 t -124.06 8.79 8.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.213 1.805 . . . . 64.0 110.149 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.9 -15.71 63.12 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.515 0.932 . . . . 74.030000000000001 113.515 -167.25 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -101.55 151.0 22.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.901 0.88 . . . . 63.119999999999997 111.75 -159.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -81.95 159.3 23.62 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.246 -1.39 . . . . 35.350000000000001 107.246 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.13 -28.85 69.93 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.702 -0.624 . . . . 60.109999999999999 112.515 -174.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.367 -0.833 . . . . 74.430000000000007 112.261 175.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.33 -30.05 60.18 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.969 -0.382 . . . . 74.239999999999995 109.969 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mm -64.99 -53.02 46.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.097 -0.705 . . . . 73.099999999999994 109.097 170.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.27 -47.38 84.61 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.237 1.015 . . . . 75.150000000000006 111.062 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.13 69.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.05 -0.406 . . . . 75.230000000000004 111.7 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.7 mt -56.95 -44.85 82.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.597 0.635 . . . . 63.43 111.816 171.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.429 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.4 OUTLIER -54.46 -20.13 7.01 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.566 1.146 . . . . 72.439999999999998 113.509 173.668 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -79.8 -14.45 58.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 120.363 1.438 . . . . 73.439999999999998 112.508 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.9 168.28 12.53 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.739 1.616 . . . . 64.010000000000005 109.557 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -96.1 -172.84 2.65 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.293 1.837 . . . . 65.010000000000005 109.952 165.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.87 -67.56 0.24 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 127.313 2.245 . . . . 63.240000000000002 111.386 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -61.84 -36.76 82.14 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.198 0.599 . . . . 72.030000000000001 110.811 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.567 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -50.46 -74.7 0.26 Allowed Glycine 0 C--N 1.338 0.673 0 C-N-CA 124.98 1.276 . . . . 62.43 110.517 172.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.24 -44.02 92.36 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.802 1.241 . . . . 70.239999999999995 111.938 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -61.05 -37.25 81.97 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.099 0.959 . . . . 71.129999999999995 110.209 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.25 81.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.83 0.741 . . . . 64.329999999999998 111.175 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 50' ' ' GLY . 3.2 t -59.02 -23.31 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 CA-C-N 118.791 0.723 . . . . 73.25 111.089 178.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -74.81 -46.5 36.36 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 120.392 -1.442 . . . . 63.340000000000003 110.298 174.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.48 60.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.911 0.884 . . . . 74.120000000000005 111.549 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.97 -25.97 24.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.746 0.308 . . . . 70.150000000000006 111.748 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -66.54 -30.3 70.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.836 0.854 . . . . 73.209999999999994 112.295 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -78.03 -25.65 47.97 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.098 -1.001 . . . . 70.420000000000002 111.524 167.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.18 45.22 0.73 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.904 1.282 . . . . 45.340000000000003 111.437 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.5 m -160.84 178.63 9.23 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 71.230000000000004 110.663 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.8 66.72 1.34 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 129.69 3.196 . . . . 53.520000000000003 106.579 -146.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.18 7.22 1.04 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.31 1.844 . . . . 74.329999999999998 112.861 -167.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 t -68.63 -6.17 24.27 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 128.348 2.659 . . . . 62.299999999999997 111.58 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -131.32 38.11 3.65 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.276 1.03 . . . . 71.420000000000002 109.984 169.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.56 123.21 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 121.511 0.672 . . . . 61.399999999999999 110.042 166.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -80.27 -60.96 2.13 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.141 -0.936 . . . . 74.209999999999994 108.906 168.623 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -80.21 102.94 9.75 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.975 -0.75 . . . . 62.310000000000002 108.975 -171.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -73.89 -28.85 61.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.328 -0.851 . . . . 74.409999999999997 111.142 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.5 m -66.36 -55.82 14.04 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 124.172 0.989 . . . . 74.400000000000006 110.503 -173.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.99 -35.73 77.59 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.726 1.21 . . . . 64.010000000000005 110.17 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -63.89 -48.35 76.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.204 0.526 . . . . 75.329999999999998 110.611 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.04 -48.94 79.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.63 0.772 . . . . 73.040000000000006 110.213 -177.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 3.6 m -55.12 -34.71 63.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.285 1.434 . . . . 74.019999999999996 112.307 170.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -60.46 -48.33 86.71 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.145 0.879 . . . . 45.409999999999997 111.064 176.804 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.6 t -61.48 -43.93 97.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 117.548 0.674 . . . . 71.209999999999994 109.324 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 31.2 mtt -53.76 -45.51 70.64 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 121.095 -1.003 . . . . 72.150000000000006 110.19 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -67.66 -29.51 68.82 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.035 -0.983 . . . . 64.109999999999999 112.722 -168.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 15.1 t -72.8 -49.36 31.07 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.351 1.432 . . . . 54.530000000000001 108.514 169.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -61.38 -33.53 73.83 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.846 -1.159 . . . . 72.219999999999999 113.774 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 -7.16 59.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.341 1.056 . . . . 64.430000000000007 112.368 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -137.33 75.25 1.52 Allowed 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.458 1.503 . . . . 72.349999999999994 109.303 177.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -111.8 89.08 2.96 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 106.025 -1.843 . . . . 64.230000000000004 106.025 165.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -87.37 86.03 7.21 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 104.011 -2.589 . . . . 45.549999999999997 104.011 164.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.519 ' HA ' ' HE3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.129 0 N-CA-C 105.327 -2.101 . . . . 62.25 105.327 -170.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.221 0 N-CA-C 109.981 -1.248 . . . . 73.420000000000002 109.981 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 t -140.83 -154.55 0.52 Allowed 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.118 2.567 . . . . 64.439999999999998 107.544 -164.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -59.25 -26.37 64.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.161 0.584 . . . . 72.010000000000005 111.978 177.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.73 -37.21 67.82 Favored 'General case' 0 C--O 1.227 -0.097 0 CA-C-N 118.539 0.609 . . . . 72.030000000000001 110.009 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.461 ' CE2' HD11 ' A' ' 9' ' ' LEU . 41.5 t80 -49.39 -57.95 6.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.1 1.36 . . . . 51.200000000000003 112.643 -166.237 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.447 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 tp60 -64.28 -35.91 82.39 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 118.821 0.737 . . . . 63.009999999999998 112.03 -177.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -38.03 77.11 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.467 -0.568 . . . . 62.100000000000001 109.467 -178.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.69 -43.13 99.59 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.6 1.16 . . . . 63.200000000000003 109.73 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.461 HD11 ' CE2' ' A' ' 5' ' ' PHE . 59.5 mt -62.35 -16.33 53.76 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.596 -0.69 . . . . 35.149999999999999 112.583 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -104.6 -6.81 20.16 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.242 1.417 . . . . 63.140000000000001 112.171 176.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.02 13.6 2.66 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.447 1.899 . . . . 72.239999999999995 112.693 -168.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.84 4.36 58.98 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.307 1.432 . . . . 44.420000000000002 112.43 -171.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -102.81 158.0 32.62 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 118.727 1.264 . . . . 74.409999999999997 110.55 -162.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.01 -164.42 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.733 1 C-N-CA 126.304 4.67 . . . . 74.420000000000002 112.916 172.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.77 -54.98 4.19 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 120.379 -1.451 . . . . 74.099999999999994 109.599 161.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -50.42 -48.98 55.98 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.412 1.085 . . . . 74.510000000000005 113.818 -164.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.81 -46.9 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 125.175 1.39 . . . . 51.439999999999998 107.696 -173.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.14 -38.3 68.04 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.476 0.58 . . . . 62.219999999999999 111.313 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.73 -16.78 62.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.09 1.145 . . . . 75.540000000000006 114.09 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.5 2.25 16.24 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.873 1.215 . . . . 74.200000000000003 113.346 170.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -103.55 -34.23 8.74 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.7 1.2 . . . . 74.0 111.058 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.32 -40.71 74.84 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.272 0.487 . . . . 75.450000000000003 110.997 176.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.62 -44.7 9.12 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 128.908 2.883 . . . . 74.349999999999994 112.357 174.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -66.8 -19.8 26.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 74.319999999999993 110.23 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -100.37 -13.19 18.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.428 1.091 . . . . 75.25 112.637 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.5 t -89.06 -30.14 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.328 1.051 . . . . 75.340000000000003 111.165 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -85.01 10.76 11.02 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.115 -0.991 . . . . 75.329999999999998 112.973 -167.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.62 24.8 76.07 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.177 0.894 . . . . 74.109999999999999 113.815 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.0 mt -79.7 -83.75 0.1 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.229 2.212 . . . . 75.310000000000002 107.032 168.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.63 165.99 15.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 123.685 0.794 . . . . 54.509999999999998 112.931 -170.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.89 155.01 24.32 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.145 1.378 . . . . 64.019999999999996 109.436 164.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -76.1 -12.97 60.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.312 -0.851 . . . . 72.340000000000003 113.172 -175.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.1 m -124.91 36.15 4.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.169 1.788 . . . . 75.140000000000001 110.364 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -81.57 15.04 2.25 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 120.981 -1.075 . . . . 75.150000000000006 112.88 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -113.25 177.17 4.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.276 -1.515 . . . . 72.409999999999997 111.077 -163.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -112.81 160.4 18.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.46 1.104 . . . . 75.209999999999994 109.232 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.3 -45.23 72.52 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.277 1.031 . . . . 74.109999999999999 109.428 173.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtt85 -58.87 -25.96 63.81 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.939 0.896 . . . . 73.310000000000002 111.685 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.93 -45.09 29.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.894 0.77 . . . . 72.040000000000006 109.557 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.1 mm -58.47 -40.39 78.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.953 0.901 . . . . 55.229999999999997 109.394 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.73 -38.64 91.3 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.632 0.651 . . . . 72.030000000000001 110.188 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.14 -33.45 65.51 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.59 1.156 . . . . 51.219999999999999 111.536 -173.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.16 -46.09 79.42 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.179 0.899 . . . . 74.200000000000003 112.791 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -22.77 64.41 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.842 0.457 . . . . 64.400000000000006 111.824 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -75.62 -12.35 60.19 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 113.136 0.791 . . . . 72.040000000000006 113.136 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -88.81 164.52 15.18 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 119.614 1.097 . . . . 74.0 109.703 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -101.73 -175.84 2.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 125.347 1.459 . . . . 75.439999999999998 109.42 169.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -46.25 -58.58 3.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.527 1.531 . . . . 72.209999999999994 112.633 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.64 -46.15 83.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 108.186 -1.042 . . . . 73.219999999999999 108.186 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.83 -52.38 53.54 Favored Glycine 0 C--N 1.341 0.843 0 N-CA-C 111.3 -0.72 . . . . 62.229999999999997 111.3 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.97 91.83 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.557 0.743 . . . . 43.299999999999997 110.908 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.0 mt -61.74 -40.12 93.96 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.46 0.573 . . . . 75.340000000000003 111.186 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -65.3 -41.33 94.21 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.148 0.431 . . . . 74.099999999999994 111.419 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.44 -41.81 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.594 0.758 . . . . 63.130000000000003 109.681 175.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.77 -41.9 64.55 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.185 0.594 . . . . 71.129999999999995 110.452 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -54.9 -52.15 63.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.68 -0.859 . . . . 53.219999999999999 108.68 175.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -68.11 -34.13 75.81 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 119.239 -0.984 . . . . 62.43 110.26 -172.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -65.35 -53.84 37.74 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.856 0.462 . . . . 63.420000000000002 110.188 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.29 -41.8 76.5 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.003 0.819 . . . . 75.209999999999994 110.002 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.37 16.22 6.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.72 0.637 . . . . 72.439999999999998 112.72 -175.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.18 165.82 11.52 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.248 -1.532 . . . . 75.209999999999994 112.563 -179.407 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -88.61 93.21 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.587 -1.642 . . . . 63.549999999999997 110.333 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -87.83 53.62 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.838 1.255 . . . . 75.430000000000007 110.166 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 p -61.94 83.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.729 2.412 . . . . 75.430000000000007 112.279 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.3 m80 51.46 33.55 10.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.365 1.466 . . . . 72.319999999999993 112.38 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.449 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -52.16 111.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 127.111 2.164 . . . . 63.420000000000002 110.55 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -56.68 -55.17 37.44 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.724 -0.61 . . . . 74.150000000000006 112.576 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -114.05 84.3 2.01 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.184 1.794 . . . . 72.150000000000006 109.292 -167.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HD3' HG13 ' A' ' 66' ' ' VAL . 41.6 mmtm -56.35 -26.83 53.97 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.676 1.191 . . . . 75.25 113.503 -172.387 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.05 -50.07 57.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 128.32 2.648 . . . . 54.520000000000003 109.262 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.8 -38.41 90.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.8 1.24 . . . . 72.040000000000006 110.405 -176.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.8 -47.86 83.22 Favored 'General case' 0 C--O 1.23 0.073 0 N-CA-C 109.153 -0.684 . . . . 73.420000000000002 109.153 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.3 tp -57.79 -52.59 64.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.336 -0.616 . . . . 63.450000000000003 109.336 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.76 -40.32 40.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.904 0.882 . . . . 73.239999999999995 111.197 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -44.64 94.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.826 0.727 . . . . 54.350000000000001 111.808 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.3 t -65.03 -43.03 96.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 122.087 -0.655 . . . . 63.340000000000003 109.799 176.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mtt -57.79 -40.25 79.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 120.799 -1.188 . . . . 62.420000000000002 111.323 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -51.82 -59.6 4.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.256 -0.878 . . . . 72.430000000000007 109.789 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -62.2 -34.49 76.56 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.898 0.772 . . . . 75.239999999999995 111.553 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.422 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 11.5 m-85 -68.06 -37.65 81.53 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 120.603 -1.311 . . . . 75.209999999999994 113.1 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -65.86 -45.9 80.42 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.867 0.758 . . . . 75.109999999999999 109.229 166.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -107.08 69.44 0.76 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.484 1.114 . . . . 53.310000000000002 110.75 -161.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -123.68 -2.76 8.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.339 0.866 . . . . 74.299999999999997 113.339 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -74.59 112.34 10.68 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.573 -1.64 . . . . 72.030000000000001 106.573 155.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm . . . . . 0 C--O 1.246 0.876 0 C-N-CA 127.157 2.183 . . . . 74.439999999999998 106.639 161.099 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.462 ' HA2' ' OD1' ' A' ' 22' ' ' ASP . . . . . . . . 0 N--CA 1.467 0.753 0 N-CA-C 110.345 -1.102 . . . . 74.030000000000001 110.345 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 t -75.35 -170.21 1.16 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.125 0.97 . . . . 61.109999999999999 109.031 166.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -35.74 78.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.119 1.368 . . . . 53.240000000000002 111.823 167.898 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -58.87 -26.95 64.72 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.065 0.946 . . . . 63.219999999999999 112.811 -169.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -45.86 -41.37 11.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.492 1.917 . . . . 73.0 112.575 175.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -70.12 -37.42 75.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.869 -0.586 . . . . 71.319999999999993 111.847 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -39.5 92.73 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.977 0.808 . . . . 42.100000000000001 109.005 171.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 40.2 mt -59.57 -48.15 82.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.751 0.705 . . . . 63.049999999999997 111.66 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 23.5 mt -51.74 -38.96 57.56 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 123.95 0.9 . . . . 74.0 110.854 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -91.92 -6.96 50.46 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.092 0.557 . . . . 64.439999999999998 112.026 -174.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.86 2.17 50.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 120.411 -1.431 . . . . 75.329999999999998 110.928 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.79 -22.75 8.05 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 124.358 0.98 . . . . 32.119999999999997 112.013 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.15 144.82 67.88 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 117.675 0.737 . . . . 65.409999999999997 110.936 -159.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.47 156.23 61.71 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 C-N-CA 121.708 1.606 . . . . 74.019999999999996 109.361 164.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -59.4 -39.97 85.13 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 124.192 0.997 . . . . 70.010000000000005 108.83 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -56.11 -45.87 79.33 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 112.193 0.442 . . . . 74.129999999999995 112.193 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.69 -50.38 50.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 108.254 -1.017 . . . . 72.150000000000006 108.254 176.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.92 -42.71 65.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.466 0.706 . . . . 61.149999999999999 111.7 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -59.24 -55.6 32.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 119.127 0.876 . . . . 62.420000000000002 110.935 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.14 -30.51 69.67 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 118.593 -0.718 . . . . 71.109999999999999 111.166 -175.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.4 tp -76.39 -36.91 57.84 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.505 1.122 . . . . 72.040000000000006 110.609 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.462 ' OD1' ' HA2' ' A' ' 1' ' ' GLY . 1.1 t70 -55.5 -39.57 70.64 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.749 0.82 . . . . 64.25 110.755 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -29.63 69.41 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.783 1.633 . . . . 74.040000000000006 112.299 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 30' ' ' VAL . 2.4 mt -65.33 -33.07 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 107.662 -1.236 . . . . 72.349999999999994 107.662 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 11.0 m-85 -90.48 7.82 36.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.382 1.873 . . . . 75.239999999999995 112.951 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -99.15 -38.01 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 O-C-N 121.186 -0.947 . . . . 55.149999999999999 109.444 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.34 -17.45 59.4 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.25 0.833 . . . . 72.109999999999999 113.25 -165.104 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.4 13.18 52.58 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.413 0.551 . . . . 44.25 111.819 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.9 mt -78.06 -55.29 5.4 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.709 -0.848 . . . . 71.450000000000003 108.709 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.439 HG12 ' HB3' ' A' ' 69' ' ' LYS . 21.3 m -140.16 156.54 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.42 0.688 . . . . 74.329999999999998 109.873 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.17 158.66 26.25 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.236 -0.653 . . . . 74.120000000000005 109.236 164.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.439 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 19.2 p80 -62.26 -24.62 67.37 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.786 -0.571 . . . . 73.120000000000005 112.14 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.6 t -107.7 15.74 24.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.173 0.989 . . . . 75.010000000000005 111.793 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.38 -23.88 64.72 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.591 -1.318 . . . . 73.319999999999993 110.989 171.827 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.18 173.95 9.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.015 1.726 . . . . 73.109999999999999 110.599 -174.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.32 175.37 9.0 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.205 1.002 . . . . 73.349999999999994 108.87 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -44.83 -45.14 9.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.443 2.297 . . . . 73.109999999999999 114.589 -171.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -60.75 -21.85 63.43 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.958 0.799 . . . . 62.020000000000003 112.063 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -58.73 4.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.218 1.007 . . . . 40.109999999999999 109.993 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.479 HD12 ' H ' ' A' ' 40' ' ' ILE . 4.4 mp -56.31 -44.89 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.42 1.088 . . . . 62.149999999999999 110.924 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -55.45 -48.64 74.17 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.697 1.199 . . . . 73.319999999999993 110.987 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.42 86.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 118.408 -0.806 . . . . 72.329999999999998 111.101 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -52.95 -37.59 61.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.767 -0.635 . . . . 74.340000000000003 111.338 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -29.48 67.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.211 0.819 . . . . 72.049999999999997 113.211 174.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -66.99 -21.4 65.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 119.72 1.146 . . . . 71.239999999999995 111.366 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -88.27 143.58 26.94 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.323 1.049 . . . . 73.030000000000001 110.928 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -69.04 178.52 2.21 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.734 2.013 . . . . 64.019999999999996 111.292 163.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -51.14 -65.28 0.58 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.797 2.039 . . . . 43.520000000000003 110.939 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -37.67 76.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.723 0.809 . . . . 73.129999999999995 110.603 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.74 -37.05 66.84 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 111.431 -0.667 . . . . 33.329999999999998 111.431 -175.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.52 91.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.587 0.693 . . . . 71.120000000000005 109.496 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 mt -56.41 -37.86 70.76 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.949 -0.47 . . . . 72.140000000000001 111.038 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.53 81.47 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.291 0.496 . . . . 72.349999999999994 112.271 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 37.4 t -51.45 -38.31 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.801 0.728 . . . . 75.219999999999999 110.277 173.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.1 mt -73.2 -53.54 10.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.331 0.653 . . . . 61.310000000000002 109.923 -176.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.1 -43.18 73.79 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 124.001 0.813 . . . . 64.25 110.106 -176.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 29.9 tt0 -69.11 -31.13 69.62 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 123.036 0.21 . . . . 63.43 110.957 -174.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -73.3 -49.46 27.38 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.148 0.979 . . . . 75.319999999999993 111.461 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -60.71 -38.76 86.15 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.876 1.216 . . . . 51.210000000000001 109.733 175.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.31 5.36 20.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.137 0.791 . . . . 74.329999999999998 113.137 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.6 p -74.44 170.65 15.24 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 119.929 1.24 . . . . 34.43 111.224 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -96.86 98.73 10.35 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.955 -1.128 . . . . 42.229999999999997 107.955 173.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.1 mt -98.99 25.39 6.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.482 1.113 . . . . 75.340000000000003 109.848 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 t -67.07 -38.86 86.51 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.26 -0.9 . . . . 64.439999999999998 111.16 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -130.97 23.65 4.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.046 0.938 . . . . 72.120000000000005 112.396 -170.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.45 165.57 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.393 1.077 . . . . 72.120000000000005 110.016 165.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -122.32 -85.68 0.65 Allowed 'General case' 0 C--O 1.234 0.256 0 N-CA-C 106.577 -1.638 . . . . 73.340000000000003 106.577 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.58 116.88 14.69 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.889 -1.152 . . . . 75.430000000000007 107.889 176.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB3' HG12 ' A' ' 30' ' ' VAL . 40.7 mmtm -64.15 -35.92 82.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.621 -0.674 . . . . 63.039999999999999 111.865 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.11 -52.51 65.22 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 126.193 1.797 . . . . 74.030000000000001 108.095 -176.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.54 -25.01 67.82 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.357 -0.838 . . . . 53.119999999999997 112.768 -175.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -74.85 -52.88 10.2 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.715 -0.846 . . . . 62.350000000000001 108.715 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.488 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.7 OUTLIER -61.28 -52.99 62.4 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.49 1.138 . . . . 75.040000000000006 109.109 -173.476 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.0 t -62.96 -20.75 65.55 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.407 -1.27 . . . . 72.340000000000003 110.741 -176.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.94 -53.44 5.79 Favored Glycine 0 C--N 1.34 0.787 0 CA-C-O 117.408 -1.773 . . . . 73.150000000000006 110.878 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 53.7 t -47.72 -50.58 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.148 1.474 . . . . 34.399999999999999 109.327 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.488 ' CE ' HD11 ' A' ' 73' ' ' LEU . 6.6 mtt -53.46 -50.98 64.15 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 119.6 -0.238 . . . . 62.329999999999998 111.007 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.548 ' HA ' HH11 ' A' ' 81' ' ' ARG . 3.5 ttmt -59.67 -47.44 85.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.612 -0.709 . . . . 74.450000000000003 110.621 -177.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.1 m -60.2 -38.58 83.73 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.134 -0.936 . . . . 53.43 111.064 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.89 -58.18 9.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.871 1.214 . . . . 71.219999999999999 111.1 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.548 HH11 ' HA ' ' A' ' 78' ' ' LYS . 6.2 ptp85 -57.88 -35.41 70.94 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 118.033 -0.984 . . . . 62.350000000000001 110.974 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -107.35 36.75 2.6 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.662 1.985 . . . . 71.349999999999994 114.381 -172.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 72.62 2.07 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.308 -1.495 . . . . 62.409999999999997 110.98 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.08 88.53 5.69 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.309 -2.108 . . . . 64.519999999999996 105.309 164.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 mmmt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 116.126 -1.892 . . . . 71.120000000000005 108.241 -146.392 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.372 0 N-CA-C 109.74 -1.344 . . . . 50.210000000000001 109.74 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 t -127.36 -177.29 4.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.288 1.994 . . . . 70.140000000000001 111.196 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.48 -20.14 64.58 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 113.555 -1.657 . . . . 62.520000000000003 112.794 167.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -74.43 -27.64 60.7 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.591 1.087 . . . . 64.340000000000003 111.05 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -44.95 -53.46 7.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.324 1.45 . . . . 74.099999999999994 111.913 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -64.32 -37.8 88.79 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.97 0.508 . . . . 74.120000000000005 112.204 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 m -64.19 -48.78 74.61 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 108.895 -0.78 . . . . 53.130000000000003 108.895 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.0 mp -58.87 -42.71 90.1 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 124.094 0.958 . . . . 74.439999999999998 110.846 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.8 mt -56.59 -27.26 57.59 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.707 0.803 . . . . 74.430000000000007 111.034 177.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -101.05 -3.2 29.78 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.002 0.819 . . . . 54.310000000000002 112.764 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -89.5 10.31 23.29 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 120.522 -1.361 . . . . 74.519999999999996 112.679 -169.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.85 3.43 42.63 Favored Glycine 0 CA--C 1.527 0.804 0 C-N-CA 125.331 1.443 . . . . 70.209999999999994 113.072 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.3 mt -111.68 157.73 38.54 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 118.785 1.293 . . . . 70.219999999999999 111.201 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.43 167.89 18.77 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.169 2.579 . . . . 65.400000000000006 111.657 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -66.01 -47.42 74.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 124.615 1.166 . . . . 50.130000000000003 109.177 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -43.27 83.17 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.525 -0.47 . . . . 74.340000000000003 111.155 -172.503 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.77 -53.84 39.57 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.566 -1.272 . . . . 71.099999999999994 107.566 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.22 -51.34 45.05 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.334 1.054 . . . . 54.200000000000003 111.628 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -55.18 -45.37 75.79 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.805 0.73 . . . . 73.409999999999997 111.536 -178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -38.85 51.72 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 118.449 -0.786 . . . . 72.0 111.031 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.19 -39.24 71.93 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 126.451 1.9 . . . . 70.319999999999993 111.099 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.01 -42.26 79.99 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.981 1.313 . . . . 73.140000000000001 111.075 -177.345 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -64.93 -22.66 67.04 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.319 1.448 . . . . 74.120000000000005 113.03 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.443 HG23 ' HE3' ' A' ' 59' ' ' LYS . 9.4 mt -70.76 -22.25 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 O-C-N 121.068 -1.02 . . . . 73.230000000000004 108.571 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.77 23.55 11.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.683 1.993 . . . . 70.5 112.126 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 91.8 t -115.45 -38.92 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.269 1.028 . . . . 72.5 110.419 174.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.28 5.55 14.4 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.511 -0.743 . . . . 71.099999999999994 112.945 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 -8.84 76.93 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 127.329 2.395 . . . . 71.510000000000005 113.539 177.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.3 mt -61.96 -60.84 3.03 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 126.419 1.887 . . . . 72.129999999999995 110.084 -165.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 m -130.34 179.16 4.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.257 -0.883 . . . . 72.010000000000005 109.88 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -122.71 164.69 17.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.465 1.106 . . . . 73.219999999999999 109.13 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -59.7 -12.09 6.35 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.08 1.141 . . . . 74.430000000000007 114.08 -173.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.63 23.99 4.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.01 1.324 . . . . 65.140000000000001 112.564 -177.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -73.84 30.66 0.08 Allowed 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.591 -1.318 . . . . 74.310000000000002 111.382 169.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.6 mt -125.18 -177.48 3.88 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.079 2.152 . . . . 44.409999999999997 110.353 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -137.06 163.03 31.73 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.04 -1.467 . . . . 64.219999999999999 107.04 172.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -55.93 -37.99 69.68 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.647 1.579 . . . . 74.400000000000006 111.51 -175.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.0 ptt180 -55.53 -36.69 67.02 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.659 0.985 . . . . 45.530000000000001 113.659 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.07 -40.5 38.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.413 -0.588 . . . . 72.409999999999997 109.413 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.3 mm -60.78 -44.1 96.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 122.995 0.518 . . . . 72.0 110.268 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.46 -50.92 65.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.466 0.706 . . . . 65.310000000000002 109.819 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.24 71.15 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 117.644 -1.17 . . . . 45.140000000000001 112.68 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.85 -46.39 90.76 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.973 1.261 . . . . 51.140000000000001 110.066 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -40.94 98.88 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 118.022 0.374 . . . . 71.310000000000002 110.389 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -76.73 43.51 0.34 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.485 1.114 . . . . 62.399999999999999 111.999 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -138.41 149.59 45.66 Favored 'General case' 0 C--O 1.233 0.193 0 O-C-N 121.087 -1.008 . . . . 72.420000000000002 108.317 162.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -68.62 163.66 23.21 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.331 1.452 . . . . 73.120000000000005 110.358 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -47.83 -70.99 0.08 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 127.455 2.302 . . . . 63.43 110.864 -179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -70.52 -23.28 62.61 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.28 -0.263 . . . . 74.120000000000005 111.24 -172.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.85 -60.74 5.83 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 109.938 -1.265 . . . . 70.430000000000007 109.938 176.305 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -47.63 -40.94 20.93 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.582 1.953 . . . . 53.32 111.884 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -46.86 83.29 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.668 1.187 . . . . 72.109999999999999 111.576 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.71 -45.84 81.6 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.036 0.446 . . . . 73.319999999999993 109.837 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.74 -37.89 62.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 123.283 0.633 . . . . 74.439999999999998 110.975 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.56 -45.37 75.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.192 -0.942 . . . . 73.400000000000006 109.938 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -56.04 -49.73 72.91 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.98 -0.748 . . . . 70.0 108.98 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -65.41 -28.2 69.08 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.14 0.427 . . . . 74.310000000000002 111.878 -174.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.86 -33.89 51.95 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.764 0.826 . . . . 62.409999999999997 112.943 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HE3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -63.04 -37.84 88.81 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.82 -1.175 . . . . 72.0 110.005 168.902 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -83.76 52.63 2.32 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.903 2.481 . . . . 74.409999999999997 109.995 -175.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.62 170.97 17.88 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.42 1.088 . . . . 71.299999999999997 110.457 170.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.46 77.4 1.09 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 125.746 1.619 . . . . 73.209999999999994 108.017 -169.561 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.17 49.53 0.69 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.161 1.384 . . . . 74.409999999999997 110.977 -175.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -111.12 -21.51 11.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.201 1.8 . . . . 72.219999999999999 112.205 -175.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -130.64 16.58 5.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.239 1.016 . . . . 71.340000000000003 111.776 176.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.5 t -90.52 104.85 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 107.586 -1.264 . . . . 63.409999999999997 107.586 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -58.43 -35.42 72.07 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.709 0.633 . . . . 65.230000000000004 112.709 175.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.5 p30 -129.07 78.74 1.87 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.988 0.899 . . . . 42.299999999999997 111.472 -170.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 44.0 mmtt -48.26 -40.68 25.46 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.516 1.526 . . . . 72.409999999999997 110.445 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.6 p -55.22 -61.01 2.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.443 2.697 . . . . 72.230000000000004 111.364 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.7 -29.81 70.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 119.111 -0.471 . . . . 72.099999999999994 111.278 -177.566 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -63.07 -52.23 63.57 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.466 -0.939 . . . . 72.120000000000005 108.466 173.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.84 -47.06 81.2 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.047 1.339 . . . . 74.129999999999995 109.836 178.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -27.13 68.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.012 0.925 . . . . 72.420000000000002 111.907 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.76 -54.84 6.96 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 109.603 -1.399 . . . . 71.140000000000001 109.603 176.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 89.0 t -52.36 -48.14 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.867 0.867 . . . . 74.140000000000001 109.562 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 36.2 mtt -50.25 -52.27 37.57 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.908 -1.12 . . . . 63.020000000000003 111.237 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.28 89.34 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 118.01 -0.995 . . . . 61.210000000000001 111.184 -171.532 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 t -67.74 -28.29 67.51 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.954 1.252 . . . . 74.319999999999993 111.178 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -71.32 -46.27 61.06 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.57 1.532 . . . . 74.310000000000002 110.612 169.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.78 24.71 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.419 -1.426 . . . . 73.129999999999995 113.068 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.98 15.23 4.25 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.015 2.126 . . . . 73.310000000000002 111.753 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 72.3 mtp85 -134.65 38.38 3.06 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.095 0.862 . . . . 74.010000000000005 111.18 -172.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -81.34 130.76 35.17 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.276 -1.009 . . . . 73.019999999999996 108.276 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.545 ' HA ' ' HE2' ' A' ' 85' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.333 0 C-N-CA 126.848 2.059 . . . . 65.319999999999993 106.307 -173.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.53 0 N-CA-C 110.574 -1.01 . . . . 64.230000000000004 110.574 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -69.18 179.73 1.84 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.382 0.61 . . . . 64.120000000000005 109.536 157.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -49.48 -35.9 21.21 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.356 1.463 . . . . 64.450000000000003 113.002 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.73 -34.6 74.65 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.184 0.993 . . . . 75.450000000000003 109.771 -166.344 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -44.77 -54.57 6.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.004 1.322 . . . . 61.119999999999997 110.486 176.34 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -66.56 -31.62 72.45 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.974 -1.013 . . . . 63.450000000000003 111.848 -176.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -60.08 -46.73 88.62 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.74 1.155 . . . . 75.25 109.63 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.45 -40.48 95.81 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.206 -0.934 . . . . 62.25 110.963 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.41 -20.09 65.25 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.796 0.725 . . . . 72.519999999999996 112.139 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -86.87 -36.78 18.24 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.366 1.066 . . . . 71.239999999999995 109.081 175.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.06 64.28 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.599 1.96 . . . . 72.340000000000003 113.38 -166.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.87 17.0 2.61 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 119.322 -0.71 . . . . 55.130000000000003 113.176 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.3 mt -112.8 148.08 38.55 Favored Pre-proline 0 C--O 1.239 0.509 0 CA-C-N 118.133 0.966 . . . . 60.130000000000003 111.96 -156.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.07 154.19 70.89 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.793 2.328 . . . . 74.409999999999997 109.112 174.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.0 -40.88 78.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 108.024 -1.102 . . . . 62.549999999999997 108.024 -168.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -56.53 18.31 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 123.741 0.65 . . . . 52.049999999999997 109.862 -175.438 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.7 t -58.36 -45.37 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 N-CA-C 108.166 -1.05 . . . . 74.540000000000006 108.166 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.24 80.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.367 0.877 . . . . 73.209999999999994 113.367 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -55.5 -35.74 65.91 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.6 0.76 . . . . 64.340000000000003 111.1 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -91.84 -15.89 27.54 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.232 1.413 . . . . 74.439999999999998 111.544 -173.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.581 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -79.45 -38.54 34.4 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 124.787 1.235 . . . . 63.530000000000001 111.799 171.631 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -52.68 -48.2 66.68 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 123.949 0.9 . . . . 61.43 109.628 -171.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -64.91 -5.25 5.67 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.082 2.153 . . . . 75.109999999999999 115.092 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.1 mt -90.82 -10.72 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 124.386 1.074 . . . . 75.409999999999997 109.544 173.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.581 ' HE2' HD23 ' A' ' 21' ' ' LEU . 67.5 m-85 -109.93 6.29 23.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.218 1.407 . . . . 74.140000000000001 113.95 -178.06 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -120.14 -5.82 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.779 1.232 . . . . 73.329999999999998 111.819 -173.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.68 6.22 23.54 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.269 -1.519 . . . . 74.109999999999999 112.311 -172.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.19 12.54 84.05 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.181 0.895 . . . . 31.23 113.614 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.69 -65.19 0.89 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.608 1.963 . . . . 73.150000000000006 109.628 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -129.84 156.98 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 N-CA-C 113.765 1.024 . . . . 75.439999999999998 113.765 171.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.97 149.86 39.21 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 125.605 1.562 . . . . 70.549999999999997 109.945 161.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -55.92 -47.96 76.57 Favored 'General case' 0 C--O 1.228 -0.062 0 C-N-CA 123.634 0.773 . . . . 61.109999999999999 110.962 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.1 t -83.77 3.2 34.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.346 0.498 . . . . 70.439999999999998 112.346 -172.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -67.48 -28.49 67.9 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.763 -1.211 . . . . 72.150000000000006 111.911 -174.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.67 155.24 40.82 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.311 -0.625 . . . . 74.519999999999996 109.311 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -111.61 167.02 10.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.388 -0.968 . . . . 74.099999999999994 108.388 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.16 -37.42 64.43 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.041 0.536 . . . . 72.340000000000003 112.313 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -54.84 -39.52 68.66 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.24 0.473 . . . . 73.0 111.828 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.02 -39.28 66.12 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.955 -0.545 . . . . 61.43 110.955 177.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.66 -46.05 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.972 0.805 . . . . 63.43 108.99 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.39 -55.73 30.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.854 1.662 . . . . 71.030000000000001 110.298 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.65 76.52 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.852 0.461 . . . . 61.210000000000001 111.176 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.49 -52.49 65.18 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.226 1.011 . . . . 73.239999999999995 110.642 173.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.53 -18.95 3.19 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 117.575 -1.202 . . . . 63.32 113.6 171.651 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -86.37 -7.13 58.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 121.896 2.134 . . . . 60.210000000000001 114.877 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -90.15 -177.34 5.12 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.547 1.521 . . . . 74.109999999999999 110.948 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -105.67 173.52 6.28 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 124.971 1.308 . . . . 62.420000000000002 108.962 162.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -53.85 -69.87 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 126.065 1.746 . . . . 75.420000000000002 111.144 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -68.47 -10.81 57.91 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.86 1.664 . . . . 75.299999999999997 111.581 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -74.24 -72.98 0.96 Allowed Glycine 0 C--N 1.339 0.719 0 N-CA-C 108.504 -1.838 . . . . 62.219999999999999 108.504 172.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.83 -36.95 49.95 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.142 0.977 . . . . 74.230000000000004 112.343 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.73 -44.97 94.82 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.909 0.884 . . . . 64.299999999999997 111.137 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.65 92.04 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.822 0.737 . . . . 63.020000000000003 111.698 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLY . 57.3 t -56.62 -30.97 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.978 1.311 . . . . 74.209999999999994 110.503 -178.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.6 mt -68.19 -45.91 72.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.426 1.49 . . . . 75.510000000000005 110.791 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 59.1 tt0 -54.37 -42.62 70.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.247 -0.649 . . . . 75.310000000000002 109.247 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -76.91 0.88 19.31 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.738 1.014 . . . . 63.119999999999997 113.738 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -110.39 -41.16 4.44 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.786 1.635 . . . . 73.299999999999997 111.402 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -28.47 68.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 120.432 -1.417 . . . . 72.200000000000003 111.029 175.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -82.59 1.75 36.57 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 118.625 -0.702 . . . . 53.310000000000002 112.716 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.5 m -92.45 -176.11 4.21 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 120.341 1.428 . . . . 71.239999999999995 111.105 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.99 79.88 1.93 Allowed 'General case' 0 C--O 1.24 0.566 0 C-N-CA 126.024 1.73 . . . . 62.399999999999999 109.246 -170.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.45 ' H ' HD22 ' A' ' 63' ' ' LEU . 1.0 OUTLIER -86.1 -6.43 59.02 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.038 -1.664 . . . . 72.439999999999998 113.309 -162.813 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.1 -62.3 1.54 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.585 1.954 . . . . 62.539999999999999 111.651 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -86.31 2.04 48.8 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.551 0.74 . . . . 72.140000000000001 112.462 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.95 151.58 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.259 -0.901 . . . . 71.129999999999995 109.504 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -83.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.414 1.886 . . . . 61.130000000000003 108.868 174.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -98.33 117.74 33.41 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 74.439999999999998 107.569 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.3 mmtm -56.6 -39.25 73.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.03 0.832 . . . . 70.310000000000002 110.859 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -47.38 74.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.631 1.172 . . . . 74.299999999999997 110.446 -174.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.29 -23.67 67.09 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.431 -0.507 . . . . 51.420000000000002 111.71 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -64.34 -55.49 20.81 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 107.873 -1.158 . . . . 65.400000000000006 107.873 173.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.98 -50.68 63.65 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.24 1.816 . . . . 64.310000000000002 110.559 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.61 -22.01 66.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.113 -0.494 . . . . 74.400000000000006 111.835 -177.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.43 -52.09 42.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.214 -1.154 . . . . 51.509999999999998 110.214 172.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.4 t -55.3 -46.4 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 123.735 0.814 . . . . 74.010000000000005 109.033 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 46.4 mtt -55.37 -41.62 72.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.077 0.769 . . . . 73.420000000000002 113.077 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.29 -46.83 85.37 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.932 0.787 . . . . 60.130000000000003 109.238 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -57.8 -56.14 25.84 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.065 0.546 . . . . 71.0 109.944 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CG ' HG22 ' A' ' 54' ' ' VAL . 22.8 m-85 -55.39 -43.58 75.32 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.976 0.807 . . . . 62.039999999999999 111.527 -178.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -3.22 37.17 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.93 -1.106 . . . . 71.420000000000002 113.847 -177.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -130.7 79.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.0 1.72 . . . . 72.120000000000005 107.714 171.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -142.77 105.95 4.58 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.563 2.345 . . . . 54.130000000000003 107.252 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -102.11 129.5 48.46 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 106.575 -1.639 . . . . 74.120000000000005 106.575 163.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.4 tptp . . . . . 0 C--O 1.253 1.289 0 N-CA-C 103.696 -2.705 . . . . 75.019999999999996 103.696 168.445 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.481 ' HA3' ' OD2' ' A' ' 22' ' ' ASP . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 109.691 -1.364 . . . . 73.239999999999995 109.691 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -137.97 -168.55 2.37 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.04 0.536 . . . . 73.120000000000005 110.012 -163.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -57.21 -29.27 63.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.057 0.943 . . . . 74.230000000000004 112.616 -177.11 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -66.86 -37.4 84.37 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 123.424 0.69 . . . . 72.049999999999997 109.3 -165.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -46.35 -59.86 2.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.577 0.751 . . . . 63.25 111.132 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -60.91 -45.93 92.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.976 -0.535 . . . . 73.25 112.228 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -68.34 -26.58 65.68 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.385 0.993 . . . . 70.040000000000006 110.824 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -35.22 77.3 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 119.857 -1.777 . . . . 73.140000000000001 110.339 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.28 -20.39 66.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.529 1.059 . . . . 51.439999999999998 111.536 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.06 -17.83 21.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.408 0.683 . . . . 61.219999999999999 112.361 175.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.61 9.51 1.39 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.227 1.411 . . . . 71.030000000000001 112.448 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.11 17.6 71.6 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.566 1.079 . . . . 33.200000000000003 113.096 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -103.76 156.32 35.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.403 1.081 . . . . 72.319999999999993 110.684 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.16 160.03 46.19 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.051 3.167 . . . . 74.230000000000004 113.062 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -63.88 -45.7 88.19 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.717 0.807 . . . . 74.340000000000003 109.248 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -23.67 65.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.901 -1.12 . . . . 52.119999999999997 112.353 -168.037 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -70.66 -56.94 9.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 N-CA-C 106.726 -1.583 . . . . 62.240000000000002 106.726 168.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.01 -40.21 60.64 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.385 0.993 . . . . 71.040000000000006 113.058 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.52 -15.19 57.21 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.52 1.528 . . . . 71.209999999999994 113.667 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.3 -18.87 12.4 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.651 1.581 . . . . 73.230000000000004 112.108 173.56 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.2 tp -92.42 -29.65 16.17 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 126.15 1.78 . . . . 74.329999999999998 111.581 -173.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.481 ' OD2' ' HA3' ' A' ' 1' ' ' GLY . 5.9 t0 -56.97 -43.88 82.09 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 123.495 0.718 . . . . 73.409999999999997 110.416 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -34.25 66.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.902 2.081 . . . . 74.25 113.811 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.482 HD12 ' HE2' ' A' ' 59' ' ' LYS . 11.5 mm -58.85 -20.69 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 123.932 0.893 . . . . 74.329999999999998 109.289 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 32' ' ' HIS . 39.5 m-85 -104.67 9.53 35.12 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.676 1.59 . . . . 74.120000000000005 112.968 177.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -116.21 -32.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.593 1.557 . . . . 75.209999999999994 111.068 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.68 24.22 0.89 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.847 0.859 . . . . 74.349999999999994 111.19 -176.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.01 80.62 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.98 1.753 . . . . 74.030000000000001 113.93 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.697 HD13 ' HE3' ' A' ' 59' ' ' LYS . 2.2 mt -73.78 -63.89 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.873 1.337 . . . . 64.030000000000001 110.527 -168.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.55 158.71 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.392 1.077 . . . . 54.420000000000002 113.465 -169.45 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.15 13.04 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 127.732 2.413 . . . . 54.149999999999999 115.47 -172.187 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 25' ' ' TYR 0.258 6.7 p-80 56.11 -21.77 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.939 2.496 . . . . 71.040000000000006 116.604 -161.452 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 23.9 5.55 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.59 1.556 . . . . 74.010000000000005 111.409 -177.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -70.15 19.13 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.617 1.967 . . . . 64.230000000000004 113.766 -175.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.8 mt -129.22 -171.83 2.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.439 1.496 . . . . 72.420000000000002 110.701 -152.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.91 169.74 17.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 126.969 2.107 . . . . 74.0 107.806 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -47.28 -46.03 24.47 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 126.537 1.935 . . . . 73.5 112.423 -169.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -54.97 -29.32 56.62 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.746 0.647 . . . . 74.200000000000003 112.746 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.63 -47.81 65.67 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 118.828 -0.606 . . . . 74.040000000000006 110.605 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.523 HD12 ' H ' ' A' ' 40' ' ' ILE . 3.6 mp -71.19 -43.46 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 119.024 0.829 . . . . 71.409999999999997 109.707 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -67.87 -48.09 67.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 119.129 -0.462 . . . . 62.119999999999997 110.456 -173.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -22.5 64.11 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.014 0.825 . . . . 73.340000000000003 111.985 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.05 -37.5 77.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.575 1.08 . . . . 71.230000000000004 111.847 166.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm -65.82 -25.63 67.31 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.803 0.729 . . . . 70.540000000000006 111.544 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -87.77 21.75 2.52 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.422 -0.799 . . . . 70.209999999999994 111.976 -167.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -125.37 156.93 37.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.924 -1.11 . . . . 54.130000000000003 109.95 175.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -67.94 169.71 9.46 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.702 -0.681 . . . . 65.420000000000002 109.534 155.696 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -50.27 -58.86 4.7 Favored 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 125.727 1.611 . . . . 73.510000000000005 109.603 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -4.04 35.03 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.317 1.047 . . . . 50.340000000000003 112.26 -174.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -86.12 -57.09 2.18 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 109.055 -1.618 . . . . 61.210000000000001 109.055 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.99 89.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.94 1.296 . . . . 73.319999999999993 112.233 -175.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.74 -44.29 93.85 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 119.18 0.9 . . . . 73.340000000000003 110.572 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.65 -43.89 93.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 120.571 -0.451 . . . . 54.43 111.226 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 61.1 t -54.34 -41.11 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.285 -0.884 . . . . 62.5 110.264 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.54 -52.22 58.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.4 -0.593 . . . . 74.299999999999997 109.4 -178.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -58.18 -33.67 69.5 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 123.759 0.662 . . . . 75.120000000000005 109.609 -174.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -91.87 -27.77 17.73 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.69 0.677 . . . . 72.530000000000001 111.745 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -62.08 -20.96 64.56 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.469 0.652 . . . . 73.200000000000003 110.971 164.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.697 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -102.57 -19.47 14.84 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 113.594 0.961 . . . . 64.299999999999997 113.594 176.322 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -80.5 59.99 3.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.059 1.744 . . . . 60.509999999999998 107.003 158.598 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.1 m -158.1 163.72 37.35 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.526 1.531 . . . . 71.099999999999994 107.708 170.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -105.92 128.91 54.09 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 105.137 -2.171 . . . . 74.510000000000005 105.137 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.0 mt -116.35 44.83 1.9 Allowed 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.701 2.4 . . . . 75.219999999999999 109.004 -172.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.3 m -59.08 95.58 0.03 OUTLIER 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.726 0.81 . . . . 71.409999999999997 111.395 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 49.14 35.05 6.56 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 128.309 2.643 . . . . 75.439999999999998 113.485 177.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.445 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -60.02 111.53 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.682 -1.229 . . . . 74.109999999999999 107.682 169.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -67.23 -40.12 86.31 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.705 -1.247 . . . . 63.340000000000003 109.762 168.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -78.32 50.45 0.93 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.201 1.4 . . . . 60.109999999999999 112.514 -170.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD3' HG13 ' A' ' 66' ' ' VAL . 35.1 mmtm -52.71 -39.93 62.49 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 120.946 -1.096 . . . . 72.409999999999997 112.196 -177.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.7 p -66.13 -53.35 38.91 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.325 1.05 . . . . 72.530000000000001 110.14 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -38.45 84.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.1 -0.476 . . . . 74.129999999999995 110.723 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -62.58 -49.55 74.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 108.93 -0.767 . . . . 75.209999999999994 108.93 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.68 -50.61 70.46 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.89 0.876 . . . . 73.239999999999995 109.795 -177.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.5 t -64.93 -21.82 66.89 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.106 0.962 . . . . 33.140000000000001 110.943 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.37 -53.46 13.29 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 126.063 1.792 . . . . 71.510000000000005 110.795 169.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -55.81 -47.93 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.736 1.268 . . . . 73.230000000000004 108.652 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 44.7 mtt -48.05 -56.9 6.63 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.95 0.9 . . . . 72.219999999999999 110.839 172.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -59.13 -43.53 92.0 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.882 -0.784 . . . . 73.230000000000004 108.882 -175.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -60.99 -35.34 76.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 119.244 -0.408 . . . . 70.319999999999993 111.647 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -65.83 -42.53 90.41 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.558 -1.339 . . . . 72.200000000000003 112.71 175.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -79.35 -15.91 57.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 118.407 -0.806 . . . . 72.140000000000001 113.108 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -142.41 88.74 2.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.535 1.934 . . . . 71.109999999999999 107.327 -174.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -124.89 3.04 8.1 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.331 1.852 . . . . 61.520000000000003 112.898 -168.494 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.97 118.72 5.25 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.713 1.205 . . . . 65.230000000000004 108.226 169.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.255 1.362 0 N-CA-C 105.041 -2.207 . . . . 74.129999999999995 105.041 173.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.445 0 N-CA-C 110.19 -1.164 . . . . 42.25 110.19 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.48 -173.41 2.52 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.743 1.217 . . . . 41.11 111.684 -169.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -44.18 -45.04 8.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.162 2.185 . . . . 73.14 110.899 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.73 -34.44 78.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.632 1.173 . . . . 75.31 110.649 -170.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.62 -50.04 69.05 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.17 0.988 . . . . 63.45 112.133 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.97 -40.59 91.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.082 -0.485 . . . . 73.52 111.253 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.3 m -61.65 -45.51 93.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.788 0.435 . . . . 72.42 110.294 175.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.3 mt -61.4 -43.15 99.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.493 0.717 . . . . 44.31 111.993 -176.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.4 mt -57.77 -40.33 79.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.587 -0.523 . . . . 63.32 109.587 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -82.09 -20.27 38.5 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.646 0.26 . . . . 72.11 111.26 -172.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.41 18.91 0.14 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.643 2.777 . . . . 75.21 111.895 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.413 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 89.18 -0.43 81.52 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 125.157 1.36 . . . . 34.1 114.115 168.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 90.8 mt -77.08 147.93 77.59 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.863 1.332 . . . . 62.21 111.107 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.32 156.93 60.54 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.152 1.901 . . . . 64.34 109.441 165.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.47 -42.93 97.24 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 124.127 0.971 . . . . 71.11 108.909 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.1 -37.15 74.0 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 118.608 -0.71 . . . . 72.21 111.602 -174.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.1 t -78.58 -47.27 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.446 1.098 . . . . 73.13 108.287 -179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.16 70.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.173 0.589 . . . . 61.21 111.578 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.41 -55.35 22.33 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.881 1.273 . . . . 71.21 110.98 178.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -45.25 83.53 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.022 0.529 . . . . 71.44 110.101 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.09 -36.08 81.2 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.095 0.558 . . . . 71.55 111.685 -167.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.61 -45.59 73.68 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.486 1.115 . . . . 74.13 110.521 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.84 -19.75 65.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 114.26 1.208 . . . . 53.42 114.26 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.413 HG22 HG22 ' A' ' 30' ' ' VAL . 14.3 mt -72.11 -27.91 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 108.746 -0.835 . . . . 71.32 108.746 177.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.65 -23.12 24.34 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.649 1.18 . . . . 75.13 111.656 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.9 t -73.14 -33.56 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 123.624 0.77 . . . . 71.43 111.262 177.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.44 17.59 15.77 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.509 0.929 . . . . 71.53 113.509 -164.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.21 33.41 78.17 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 123.781 0.705 . . . . 75.45 114.343 170.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -94.48 -75.03 0.52 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 127.295 2.238 . . . . 74.24 108.883 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.413 HG22 HG22 ' A' ' 24' ' ' ILE . 17.6 m -123.32 163.66 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.64 1.176 . . . . 74.53 110.057 -174.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.86 160.73 25.96 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.901 0.481 . . . . 74.14 110.492 167.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.67 -28.08 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.566 -0.709 . . . . 61.41 110.169 166.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.2 p -81.69 -1.05 45.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.098 0.959 . . . . 74.34 112.272 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.47 -13.24 61.39 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.354 -0.841 . . . . 75.32 112.95 -171.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.35 156.99 21.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.624 1.169 . . . . 55.35 111.246 -174.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -91.35 163.21 14.29 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.398 1.079 . . . . 42.31 108.186 164.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -61.87 -28.35 69.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.764 0.426 . . . . 51.35 110.589 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -62.63 -29.92 70.98 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.795 -1.191 . . . . 74.11 111.059 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.87 -47.09 49.07 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.644 -0.693 . . . . 33.32 109.824 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.0 mm -57.22 -38.69 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.587 0.63 . . . . 55.31 110.224 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.44 -54.44 8.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.101 0.56 . . . . 61.13 110.573 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.2 64.65 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.26 0.467 . . . . 72.54 112.26 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 mt -63.11 -42.9 99.66 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.757 1.223 . . . . 74.43 111.714 171.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -70.52 -24.34 62.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.767 1.167 . . . . 63.15 110.957 173.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -76.84 34.6 0.15 Allowed 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.155 -0.966 . . . . 62.43 111.503 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -134.49 151.93 51.46 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.286 1.034 . . . . 71.13 108.403 165.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -78.86 176.73 9.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.191 0.52 . . . . 64.53 109.784 161.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -61.3 2.51 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 125.863 1.665 . . . . 73.25 111.32 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -67.07 -24.48 65.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.081 0.552 . . . . 55.03 111.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.52 -69.64 1.22 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 109.331 -1.508 . . . . 52.43 109.331 170.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.43 -41.27 76.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.26 1.424 . . . . 52.02 111.503 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.9 mt -62.03 -39.4 92.19 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 118.37 -0.824 . . . . 71.51 111.501 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.29 84.42 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.572 0.624 . . . . 75.22 110.012 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 t -55.4 -40.68 58.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.371 0.532 . . . . 73.52 110.569 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.26 -45.72 69.03 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.623 0.769 . . . . 64.11 109.794 -176.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -58.49 -51.73 68.64 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.885 0.741 . . . . 73.23 109.462 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -69.57 -30.68 68.52 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.531 0.605 . . . . 60.11 111.407 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -67.13 -39.82 86.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.865 1.266 . . . . 74.33 111.266 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -43.71 78.25 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.493 -0.754 . . . . 60.43 110.083 171.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -76.96 46.49 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.497 1.919 . . . . 63.33 110.212 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.96 -174.77 3.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.923 2.089 . . . . 61.34 107.686 170.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -120.02 112.27 18.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.628 1.171 . . . . 54.34 108.565 176.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.0 mt -95.59 30.2 2.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.297 1.439 . . . . 71.42 110.295 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.95 -69.89 0.34 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.933 -1.136 . . . . 65.44 107.933 163.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -80.19 39.22 0.44 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.27 1.428 . . . . 73.42 113.083 -173.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -106.91 165.17 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.128 0.971 . . . . 53.52 108.83 170.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.68 -70.52 0.33 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.99 1.316 . . . . 72.15 108.9 170.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -56.99 75.8 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 128.993 2.917 . . . . 75.44 111.204 159.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -51.24 -32.04 22.89 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.262 -0.899 . . . . 74.12 111.644 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.8 p -65.47 -56.84 10.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 118.587 0.63 . . . . 64.55 109.977 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.67 -33.97 68.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.257 0.623 . . . . 73.11 111.436 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -60.82 -53.08 61.67 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.299 0.571 . . . . 72.23 109.945 176.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.1 tp -62.46 -42.45 99.47 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-O 121.445 0.641 . . . . 65.22 110.025 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.42 -37.75 68.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.79 1.636 . . . . 72.51 110.379 176.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.66 -57.4 17.91 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 124.966 1.27 . . . . 74.42 110.462 174.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.44 -47.86 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 117.804 0.802 . . . . 40.03 109.366 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.4 mtt -52.78 -46.74 67.74 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.985 0.914 . . . . 72.24 112.165 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -57.8 -49.92 75.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 118.796 0.725 . . . . 61.32 109.52 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -43.42 54.7 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.465 0.706 . . . . 62.12 111.647 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -71.8 -38.12 70.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.166 1.172 . . . . 72.31 114.166 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -73.66 -21.87 60.14 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.97 1.259 . . . . 74.44 111.786 172.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 . . . . . 0 N--CA 1.45 -0.442 0 C-N-CA 124.399 1.08 . . . . 61.34 108.609 -177.461 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 109.801 -1.32 . . . . 72.54 109.801 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t -129.34 -175.05 3.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.518 1.127 . . . . 70.1 110.453 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.19 -17.6 64.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 126.649 1.98 . . . . 74.31 113.924 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -67.95 -36.94 80.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.136 0.88 . . . . 65.2 109.09 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.53 ' CE2' HD11 ' A' ' 9' ' ' LEU . 54.8 t80 -46.51 -53.35 11.46 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 125.897 1.679 . . . . 62.24 112.577 -177.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.45 -47.26 86.15 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.769 0.428 . . . . 45.2 111.552 -175.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.7 m -67.93 -35.59 78.69 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.042 -0.355 . . . . 74.12 110.042 -176.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.7 -34.96 60.43 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.38 -0.825 . . . . 73.34 112.067 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.53 HD11 ' CE2' ' A' ' 5' ' ' PHE . 17.3 mt -54.54 -36.23 64.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.32 0.648 . . . . 72.43 110.063 166.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -83.46 -21.07 32.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.669 0.788 . . . . 74.43 111.705 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 1.51 6.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.519 1.928 . . . . 71.43 112.236 174.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.47 0.79 46.9 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.683 1.135 . . . . 51.14 113.28 174.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.7 mt -84.94 144.72 42.19 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 118.241 1.02 . . . . 73.2 109.636 -169.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.91 156.04 56.62 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.922 1.748 . . . . 52.0 110.285 173.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -59.32 -45.7 90.59 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 124.951 1.3 . . . . 62.11 108.698 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -39.59 86.95 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.366 0.416 . . . . 74.33 111.098 -172.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.72 -58.78 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.681 1.592 . . . . 63.33 107.994 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.47 -44.99 46.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.448 1.099 . . . . 61.42 112.532 -174.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -58.6 -41.76 86.58 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.458 1.026 . . . . 44.41 111.467 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.61 -39.55 64.49 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.809 -0.557 . . . . 74.33 110.739 177.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.9 tp -69.76 -39.64 76.57 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.852 1.261 . . . . 73.32 110.811 -169.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -53.85 -47.1 71.32 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.952 1.301 . . . . 74.11 110.819 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.76 -24.78 58.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.77 1.628 . . . . 65.55 113.468 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -75.07 -25.09 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.128 -0.983 . . . . 72.25 109.183 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -89.43 -10.4 46.58 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.885 1.674 . . . . 70.32 112.706 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.8 t -84.79 -32.84 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 124.406 1.082 . . . . 65.32 111.975 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.73 13.86 16.97 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.91 0.777 . . . . 73.34 112.985 -168.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 61.55 31.44 77.68 Favored Glycine 0 CA--C 1.53 1.004 0 O-C-N 121.617 -0.677 . . . . 54.14 112.4 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.451 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 22.1 mt -83.54 -65.02 1.06 Allowed 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 126.799 2.04 . . . . 71.13 108.282 175.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.8 m -128.69 156.83 41.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 123.157 0.583 . . . . 71.02 109.894 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.48 154.65 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.267 0.627 . . . . 50.25 110.192 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.2 p80 -62.42 -15.1 47.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 118.729 -0.653 . . . . 73.25 112.547 175.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.8 p -120.22 22.25 11.45 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.217 1.807 . . . . 74.11 112.319 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -84.94 -3.49 58.76 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 123.265 1.507 . . . . 73.24 112.713 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -94.53 -172.86 2.87 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 126.334 1.854 . . . . 71.32 109.47 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -127.21 175.59 8.04 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.366 0.666 . . . . 74.42 111.584 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -63.69 -32.69 74.26 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.563 0.745 . . . . 75.23 111.282 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.1 mtp180 -61.83 -37.29 83.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.497 0.719 . . . . 74.35 109.947 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.17 93.94 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.651 0.78 . . . . 63.11 110.867 175.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.62 -50.92 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.954 0.797 . . . . 62.14 109.965 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -62.11 -51.25 68.67 Favored 'General case' 0 C--O 1.23 0.059 0 N-CA-C 109.875 -0.417 . . . . 71.22 109.875 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.47 69.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.164 -0.922 . . . . 74.41 112.299 -176.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.07 -51.73 67.91 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.955 0.798 . . . . 74.55 110.661 169.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.11 -39.99 83.97 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.003 0.82 . . . . 72.41 111.487 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -77.12 38.45 0.22 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-N 119.285 0.948 . . . . 74.54 112.473 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -129.1 146.75 50.97 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.335 -1.357 . . . . 72.33 107.335 161.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -68.49 170.3 9.31 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.826 0.346 . . . . 74.14 110.483 163.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -47.53 -64.17 0.86 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 127.38 2.272 . . . . 64.55 110.786 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -31.12 71.84 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 123.365 0.666 . . . . 73.43 110.871 -172.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.84 -53.95 10.56 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 110.319 -1.112 . . . . 62.24 110.319 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.5 -37.63 75.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.8 1.24 . . . . 70.24 111.599 177.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.98 -43.32 95.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 119.447 1.021 . . . . 65.53 110.937 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.512 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -61.74 -45.07 95.53 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.992 0.901 . . . . 61.14 110.785 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.23 -37.5 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.939 0.896 . . . . 50.42 110.315 176.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.03 -48.6 20.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 119.057 0.844 . . . . 70.14 110.994 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -57.5 -41.74 81.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.592 -0.892 . . . . 72.34 108.592 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -82.65 -10.07 59.1 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 112.866 0.691 . . . . 74.35 112.866 -176.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -67.18 -61.03 2.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.805 -0.813 . . . . 74.52 108.805 166.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -65.74 -39.73 91.39 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 118.697 -0.668 . . . . 70.44 110.453 -178.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -82.73 54.63 2.74 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.289 1.436 . . . . 63.14 110.145 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.97 -172.75 4.13 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.853 2.061 . . . . 74.24 107.999 173.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -129.51 114.69 16.42 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.212 1.405 . . . . 73.12 108.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.97 24.39 7.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.651 2.38 . . . . 70.32 110.8 -176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.6 t -70.5 -22.64 62.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.05 1.34 . . . . 33.51 112.512 -177.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -125.41 12.6 8.14 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.509 1.123 . . . . 63.52 112.301 -171.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.2 p -90.84 140.42 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.883 0.765 . . . . 70.43 109.314 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.404 ' NE2' HD21 ' A' ' 68' ' ' ASN . 0.0 OUTLIER -84.14 -36.2 23.09 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 122.287 -0.258 . . . . 62.22 111.183 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . 0.404 HD21 ' NE2' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -137.9 118.56 14.01 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.424 1.49 . . . . 72.24 107.303 -163.153 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -64.4 -39.14 93.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.171 0.804 . . . . 70.51 113.171 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -40.33 94.41 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 124.884 1.274 . . . . 72.14 107.677 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.16 -19.3 65.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.857 0.753 . . . . 42.14 112.61 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -79.3 -51.24 9.7 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 122.15 0.976 . . . . 73.44 108.591 173.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.73 -47.27 86.31 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.203 -1.362 . . . . 71.33 108.408 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.6 p -59.91 -26.69 66.12 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.768 1.627 . . . . 63.35 110.411 -176.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.2 -53.05 5.36 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.154 -0.779 . . . . 74.35 111.154 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.9 t -57.23 -40.58 74.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 117.375 0.587 . . . . 71.24 110.031 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.0 mtt -55.48 -45.08 77.01 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 121.358 -0.839 . . . . 62.31 111.073 175.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -63.5 -54.75 31.43 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 108.908 -0.775 . . . . 74.22 108.908 -171.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.3 t -63.83 -36.81 85.13 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.889 -0.577 . . . . 45.05 110.543 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.512 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 2.4 m-85 -58.26 -44.73 88.52 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 120.14 1.336 . . . . 74.33 113.36 174.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.04 -11.51 59.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.253 0.479 . . . . 64.55 111.487 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 . . . . . 0 C--O 1.236 0.369 0 C-N-CA 125.244 1.418 . . . . 65.34 109.155 177.152 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.396 0 N-CA-C 111.442 -0.663 . . . . 65.51 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.43 -172.83 3.0 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.921 1.688 . . . . 73.25 110.579 -177.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -45.15 -44.15 10.47 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.483 2.313 . . . . 71.51 110.343 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.76 -39.14 80.11 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.461 1.104 . . . . 74.52 110.317 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -53.12 -57.96 8.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.269 1.027 . . . . 71.45 111.204 -175.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -65.04 -39.05 92.77 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.25 -0.58 . . . . 72.45 110.554 -175.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.6 m -65.8 -36.79 84.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.168 0.44 . . . . 64.23 110.122 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.13 -37.18 86.2 Favored 'General case' 0 C--N 1.34 0.179 0 O-C-N 120.816 -1.177 . . . . 70.45 111.105 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.2 mm? -65.52 -18.58 65.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 119.13 -0.462 . . . . 72.42 111.79 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.74 -14.16 21.0 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.778 0.831 . . . . 65.04 111.511 173.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.23 -0.34 14.1 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.033 1.733 . . . . 70.25 112.382 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.29 14.91 24.82 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.716 -1.047 . . . . 62.23 113.304 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.8 mt -113.12 152.44 45.03 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 118.927 1.364 . . . . 74.42 111.815 -166.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.3 160.41 48.89 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.005 2.47 . . . . 71.14 110.911 172.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.509 ' HA ' HD11 ' A' ' 9' ' ' LEU . 14.7 tt0 -64.43 -46.0 85.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.252 -1.018 . . . . 64.52 108.252 178.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.79 -38.11 74.92 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.568 0.951 . . . . 71.33 113.568 -170.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.7 t -78.63 -43.05 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.605 -1.257 . . . . 53.12 107.605 178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.3 -32.32 56.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.968 0.804 . . . . 22.2 111.927 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.02 -23.25 65.27 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 114.367 1.247 . . . . 64.33 114.367 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.84 -6.14 20.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 118.947 0.794 . . . . 73.12 111.92 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 25' ' ' TYR . 1.2 tt -104.66 -27.96 11.51 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 124.762 1.225 . . . . 74.55 111.59 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.04 -41.86 88.86 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.314 0.961 . . . . 53.23 111.484 173.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.96 -24.24 51.61 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.232 1.413 . . . . 73.45 114.002 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.423 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.0 mt -73.25 -18.12 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.801 0.841 . . . . 73.25 109.436 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.592 ' HE2' HD23 ' A' ' 21' ' ' LEU . 65.3 m-85 -99.79 -27.77 13.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.445 1.498 . . . . 74.11 112.651 175.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.3 t -58.87 -51.06 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-O 118.996 -0.526 . . . . 71.45 110.496 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.08 0.88 46.61 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.93 1.085 . . . . 62.42 113.93 -162.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 44.34 87.96 Favored Glycine 0 CA--C 1.529 0.92 0 O-C-N 121.245 -0.909 . . . . 64.24 112.016 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.4 mt -82.09 -74.59 0.34 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 126.552 1.941 . . . . 74.24 107.035 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 m -103.34 146.84 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 N-CA-C 113.83 1.048 . . . . 44.11 113.83 172.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.17 26.89 0.06 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 129.003 2.921 . . . . 72.34 116.46 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . 0.303 2.9 p80 55.46 -21.24 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.828 2.851 . . . . 63.02 116.75 -165.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.1 p -129.14 16.55 6.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.447 1.476 . . . . 70.05 112.118 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.73 -15.41 58.46 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.299 1.44 . . . . 70.12 113.709 -173.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.14 170.41 10.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.619 1.568 . . . . 74.05 111.601 -160.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -105.45 158.51 16.61 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.831 -0.803 . . . . 64.01 108.831 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -47.59 -46.86 28.67 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.769 2.028 . . . . 52.24 110.45 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -59.16 -35.19 73.09 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 122.987 0.515 . . . . 72.41 111.973 -176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.88 62.38 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.442 -0.79 . . . . 73.02 110.291 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 6.9 mm -71.79 -41.12 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 74.15 110.135 175.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.64 -58.59 6.46 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.867 -0.79 . . . . 73.1 108.867 175.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.85 -40.2 63.19 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.245 1.018 . . . . 70.32 111.471 -174.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.2 mt -46.99 -54.09 10.94 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 124.424 1.09 . . . . 62.41 111.541 173.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -28.6 69.22 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.462 0.574 . . . . 72.22 111.773 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -73.25 -16.22 61.4 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.479 -0.763 . . . . 65.03 112.441 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -85.93 137.44 32.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.567 1.147 . . . . 74.53 110.937 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.36 166.01 3.28 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 113.341 -1.754 . . . . 72.32 110.677 156.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.14 -58.16 9.12 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 113.946 -1.479 . . . . 72.22 110.553 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.03 -30.95 70.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.874 0.369 . . . . 75.52 111.406 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.26 -66.98 2.44 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 108.564 -1.814 . . . . 54.04 108.564 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.5 -42.0 70.26 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.986 0.735 . . . . 51.2 112.986 -177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.14 -41.61 88.72 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.763 0.825 . . . . 72.54 111.405 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.432 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -73.1 -42.51 62.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.361 0.264 . . . . 42.4 110.812 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 70.0 t -54.28 -29.85 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.442 1.497 . . . . 71.21 110.27 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.561 HD21 HD12 ' A' ' 21' ' ' LEU . 13.7 mt -77.48 -54.52 6.32 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.36 1.064 . . . . 74.31 109.013 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -56.76 -51.09 70.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 123.634 0.584 . . . . 71.44 109.869 -175.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -72.29 -7.5 49.8 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.267 0.84 . . . . 70.42 113.267 -172.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -93.64 -58.41 2.28 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 125.833 1.653 . . . . 72.22 110.216 174.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -58.05 -33.37 68.93 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.591 1.156 . . . . 70.13 110.885 178.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -76.77 52.33 0.83 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.247 1.819 . . . . 61.55 109.977 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m -154.73 171.56 19.35 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 120.23 -1.544 . . . . 71.11 109.814 168.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -110.68 96.98 6.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.084 1.354 . . . . 64.45 107.673 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.5 mt -89.65 -6.25 56.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 118.1 -0.952 . . . . 72.23 112.782 -164.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.84 -56.06 5.85 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 73.31 111.722 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -101.2 9.93 41.35 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.42 0.688 . . . . 72.21 112.415 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.6 t -73.5 104.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 106.803 -1.555 . . . . 72.43 106.803 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -62.67 -28.04 69.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.326 1.05 . . . . 72.41 113.251 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -129.15 96.15 4.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.996 0.918 . . . . 73.12 108.639 177.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -54.27 -33.83 59.48 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.218 1.007 . . . . 73.02 109.999 172.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 m -69.66 -51.04 38.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.789 1.635 . . . . 74.25 111.39 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.18 74.45 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.15 0.432 . . . . 74.22 110.393 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -64.73 -51.8 60.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.02 -0.733 . . . . 72.23 109.02 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.3 tp -67.62 -58.09 5.3 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.628 1.171 . . . . 73.42 110.205 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -22.54 66.94 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.601 -0.727 . . . . 74.12 110.983 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.42 -48.44 14.03 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.193 -0.782 . . . . 25.0 111.35 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.0 t -55.31 -45.19 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 118.453 1.126 . . . . 74.11 109.678 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.1 mtt -50.78 -51.41 50.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.471 0.578 . . . . 64.23 111.147 171.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -49.09 73.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.826 -0.607 . . . . 73.23 110.357 -174.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -46.47 89.46 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.379 0.536 . . . . 42.12 110.8 175.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.432 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 1.5 m-85 -54.28 -52.63 60.82 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.76 0.709 . . . . 73.13 111.84 -175.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -67.92 -9.33 44.26 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.132 0.573 . . . . 71.14 111.493 -177.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 . . . . . 0 N--CA 1.45 -0.427 0 C-N-CA 126.379 1.872 . . . . 73.1 110.573 -179.261 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.484 0 N-CA-C 109.563 -1.415 . . . . 43.44 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 t -101.83 -178.39 3.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.461 0.648 . . . . 71.13 110.734 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.91 -24.35 66.9 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.175 -0.466 . . . . 64.43 111.499 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.44 -40.84 83.66 Favored 'General case' 0 C--N 1.346 0.423 0 N-CA-C 109.022 -0.733 . . . . 71.15 109.022 -176.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -45.16 -53.44 8.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.853 1.261 . . . . 73.42 112.545 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -65.47 -41.6 93.16 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.224 -0.417 . . . . 72.43 111.602 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -65.66 -31.43 72.44 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.475 0.71 . . . . 71.32 110.769 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.53 -40.55 76.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.884 -1.135 . . . . 70.12 110.268 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 15' ' ' GLN . 1.1 mm? -62.14 -23.47 66.59 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.984 0.811 . . . . 62.34 111.579 176.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.82 -18.87 38.95 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.508 0.594 . . . . 53.02 111.647 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.38 -0.46 29.16 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.972 -1.08 . . . . 51.32 112.754 -161.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 7.09 45.67 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.429 1.014 . . . . 54.42 111.964 -171.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.0 144.92 28.66 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 118.504 1.152 . . . . 74.13 110.04 -172.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.72 163.21 38.02 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.117 1.878 . . . . 61.4 110.228 167.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.421 ' HA ' HD11 ' A' ' 9' ' ' LEU . 27.1 tt0 -57.7 -48.12 80.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.312 -0.996 . . . . 73.44 108.312 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HD3' HD11 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -60.46 -31.45 70.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 112.896 0.702 . . . . 75.21 112.896 -169.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.15 -51.5 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.288 1.435 . . . . 71.5 108.591 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -38.65 71.84 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.427 0.691 . . . . 73.53 111.98 -177.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.0 -48.1 52.64 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.804 1.642 . . . . 75.31 110.966 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.29 31.58 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 124.563 1.145 . . . . 72.54 110.465 -175.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.47 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -66.37 -42.83 87.44 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 119.419 1.008 . . . . 62.1 111.376 177.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -51.02 -41.52 59.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.337 1.055 . . . . 64.52 111.328 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -53.29 -36.62 61.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 127.594 2.358 . . . . 75.2 112.712 177.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.4 mt -74.5 -14.07 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.093 0.957 . . . . 63.54 108.64 -174.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.47 ' CE2' HD23 ' A' ' 21' ' ' LEU . 45.2 m-85 -100.58 -8.95 22.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.792 1.637 . . . . 72.5 112.086 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 84.5 t -78.55 -34.5 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 125.496 1.518 . . . . 74.24 111.265 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 -3.89 58.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.235 1.198 . . . . 51.24 114.235 -161.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 63.97 28.9 73.45 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 121.363 -0.836 . . . . 74.44 111.46 -163.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 mt -71.36 -81.94 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 128.253 2.621 . . . . 74.51 105.783 162.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.0 m -124.71 176.79 5.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 123.724 0.81 . . . . 71.12 111.48 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.37 155.25 20.21 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 125.184 1.393 . . . . 74.34 108.044 166.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -48.77 -32.32 8.41 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.605 1.562 . . . . 71.33 112.343 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.07 5.88 31.55 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.998 2.119 . . . . 71.1 113.47 -175.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.82 -15.21 63.44 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 119.276 -2.14 . . . . 72.5 114.522 -177.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.6 mt -95.89 136.94 35.66 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.753 0.821 . . . . 73.42 111.729 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.79 155.33 40.92 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.136 -1.431 . . . . 73.42 107.136 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.12 -32.6 71.16 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.787 -0.57 . . . . 71.54 110.961 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -61.89 -29.63 70.33 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.684 0.794 . . . . 73.14 112.773 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.97 -35.87 31.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.644 -0.502 . . . . 73.34 109.644 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mm -60.86 -43.26 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.657 0.662 . . . . 70.41 109.28 172.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.24 -55.85 24.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.431 1.092 . . . . 70.11 110.244 171.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.97 -37.76 74.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 119.224 -0.417 . . . . 54.03 111.743 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -42.28 78.81 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.479 0.712 . . . . 74.24 111.596 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -25.89 67.08 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.627 0.648 . . . . 74.51 112.585 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -75.87 -13.28 60.27 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 120.007 1.276 . . . . 64.21 113.118 -173.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -90.69 135.53 33.65 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.514 1.526 . . . . 54.1 108.714 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -65.97 170.01 6.06 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.278 -0.873 . . . . 54.14 110.595 163.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -46.78 -64.39 0.78 Allowed 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 126.997 2.119 . . . . 73.42 111.52 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -64.15 -36.69 84.85 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.009 0.524 . . . . 74.23 111.817 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -64.87 -46.36 89.72 Favored Glycine 0 C--N 1.34 0.797 0 N-CA-C 110.617 -0.993 . . . . 54.32 110.617 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.56 82.01 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.932 1.693 . . . . 73.51 110.395 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.527 HD11 ' HD3' ' A' ' 16' ' ' LYS . 48.0 mt -55.19 -45.63 75.81 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.713 0.688 . . . . 74.5 110.362 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.15 82.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.74 0.274 . . . . 72.22 111.74 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 77' ' ' MET . 41.9 t -56.64 -41.94 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.29 1.036 . . . . 74.5 110.564 175.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.15 -43.29 78.61 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.668 -0.645 . . . . 74.41 110.213 -174.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -62.93 -39.81 95.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.384 -0.969 . . . . 71.23 108.384 -176.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -74.19 -31.14 62.54 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 118.273 0.488 . . . . 75.4 111.231 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.71 -57.99 10.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.916 0.486 . . . . 73.41 109.892 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -21.97 66.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.336 -0.84 . . . . 74.43 112.105 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -74.99 49.01 0.41 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.42 1.009 . . . . 62.44 109.564 164.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.7 m -152.52 150.05 29.17 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.362 1.465 . . . . 52.31 111.566 172.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -97.58 87.21 4.02 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 122.946 1.355 . . . . 71.3 109.617 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 mt -76.76 46.33 0.45 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.619 1.968 . . . . 43.4 111.378 -172.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.8 m -95.04 -5.46 44.38 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.526 1.531 . . . . 64.53 112.607 167.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -125.72 41.2 3.57 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.498 -1.376 . . . . 70.11 111.463 -175.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.69 100.58 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 124.899 1.279 . . . . 74.33 109.959 -168.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.582 ' H ' ' NE2' ' A' ' 67' ' ' GLN . 1.3 pm0 -65.69 -47.07 76.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.32 1.048 . . . . 74.13 112.599 176.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -107.43 99.03 8.57 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 106.589 -1.634 . . . . 65.44 106.589 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -60.35 -34.72 74.24 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.079 0.466 . . . . 74.42 109.964 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 72.5 p -64.71 -55.53 19.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.634 1.174 . . . . 61.33 110.659 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.88 -26.73 67.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 119.081 -0.485 . . . . 73.24 112.028 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -63.31 -54.34 38.55 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.696 0.68 . . . . 72.23 109.866 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.72 -52.88 63.8 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.967 0.907 . . . . 74.4 109.613 -178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.11 -29.29 65.38 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 115.749 -0.66 . . . . 54.32 112.194 176.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.61 -39.15 90.71 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.708 1.147 . . . . 64.4 112.263 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 94.9 t -64.67 -48.52 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 107.67 -1.233 . . . . 74.43 107.67 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.402 ' HG3' HG11 ' A' ' 54' ' ' VAL . 6.0 mtp -58.52 -33.14 69.52 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.011 -1.056 . . . . 71.4 112.297 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -58.05 -58.15 9.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.84 -0.8 . . . . 70.4 108.84 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.9 t -62.49 -50.1 72.73 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.934 -0.555 . . . . 74.12 110.157 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -49.14 -28.66 4.51 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 117.475 2.398 . . . . 65.24 117.475 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -115.28 0.24 13.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.337 0.971 . . . . 63.5 112.659 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 . . . . . 0 CA--C 1.545 0.773 0 C-N-CA 126.738 2.015 . . . . 72.32 108.799 159.456 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.775 0 N-CA-C 110.569 -1.013 . . . . 62.15 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -127.16 -165.37 1.46 Allowed 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.985 0.914 . . . . 74.53 110.755 -173.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -55.07 -28.95 56.26 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 113.921 1.082 . . . . 73.55 113.921 -166.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -34.65 78.54 Favored 'General case' 0 N--CA 1.461 0.103 0 C-N-CA 123.525 0.73 . . . . 71.43 110.447 -177.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -54.79 -47.53 73.85 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.491 1.116 . . . . 74.32 110.348 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -62.26 -49.48 75.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.947 -0.549 . . . . 71.53 110.378 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -55.08 -49.55 71.4 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.425 1.09 . . . . 70.45 109.703 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.4 mt -65.8 -39.2 90.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 O-C-N 121.67 -0.644 . . . . 72.15 111.257 -177.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -64.13 -15.13 59.09 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 118.768 -0.634 . . . . 72.43 111.522 175.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.77 2.35 27.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.895 1.678 . . . . 74.23 112.711 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -96.95 24.3 6.35 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.039 1.336 . . . . 71.34 111.861 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.95 16.9 78.29 Favored Glycine 0 CA--C 1.525 0.692 0 O-C-N 121.18 -0.95 . . . . 62.15 112.979 -177.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -111.02 156.82 40.26 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 118.65 1.225 . . . . 72.51 111.371 -173.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.82 173.92 13.69 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.259 3.306 . . . . 63.44 113.917 175.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -76.68 -46.01 27.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 126.377 1.871 . . . . 73.55 111.055 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -57.37 -42.08 81.41 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 118.948 0.794 . . . . 65.25 111.34 -176.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.3 t -58.49 -63.28 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 125.017 1.327 . . . . 72.11 108.107 168.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.21 -47.27 24.44 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.161 1.385 . . . . 71.53 112.012 -171.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -53.01 -56.9 12.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.624 1.569 . . . . 71.03 110.828 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -67.4 -38.65 85.01 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.907 -0.405 . . . . 50.43 109.907 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.22 -42.65 65.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.206 1.402 . . . . 70.54 110.976 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -49.82 -50.52 44.83 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.017 1.727 . . . . 73.55 110.461 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.17 -16.3 52.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.947 1.699 . . . . 73.25 113.617 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.2 mt -73.75 -31.38 31.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 120.994 -1.066 . . . . 64.5 108.707 175.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -85.39 -48.38 9.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.882 0.873 . . . . 74.55 110.228 -177.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -53.83 -39.53 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.58 0.752 . . . . 73.23 111.758 -175.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.75 0.31 7.35 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.129 0.971 . . . . 73.22 112.888 -175.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.83 7.01 71.63 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 125.327 1.442 . . . . 63.3 112.793 174.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 59' ' ' LYS . 39.8 mt -75.91 -59.8 2.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.13 0.965 . . . . 74.13 109.704 -166.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.7 167.25 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.24 1.016 . . . . 70.22 112.248 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.2 155.26 27.47 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.774 0.829 . . . . 71.2 109.779 171.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -73.8 -38.18 64.7 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.949 -0.469 . . . . 72.31 110.661 175.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.33 7.72 9.0 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.72 0.691 . . . . 72.22 112.395 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.02 -4.36 40.84 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.991 1.108 . . . . 73.13 113.991 -166.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.492 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -107.46 169.44 8.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.727 1.211 . . . . 73.41 110.325 -175.832 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -108.36 172.11 7.02 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.27 1.428 . . . . 74.34 109.836 -173.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.1 -44.64 64.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.037 1.335 . . . . 74.41 111.344 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -57.56 -22.84 47.12 Favored 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 125.795 1.638 . . . . 73.4 113.673 175.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.2 -36.38 34.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.939 -1.029 . . . . 74.33 110.283 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.8 mm -63.41 -59.75 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 108.218 -1.031 . . . . 74.14 108.218 172.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -58.98 -47.55 84.75 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.231 1.012 . . . . 70.2 111.189 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -30.14 66.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 118.012 -0.994 . . . . 71.44 111.712 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.3 -38.35 65.82 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-N 119.728 1.149 . . . . 65.5 111.204 170.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -64.01 -26.42 68.56 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.777 0.717 . . . . 74.21 111.525 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -74.88 -18.04 60.49 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.685 -0.634 . . . . 74.43 112.051 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -88.52 140.5 29.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.203 1.001 . . . . 71.34 109.521 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -69.23 176.22 3.42 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.27 -1.332 . . . . 70.14 109.367 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -54.76 -59.28 4.93 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.22 -1.354 . . . . 74.25 111.673 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.56 -27.89 45.91 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 119.64 -0.219 . . . . 51.52 110.972 -170.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.17 -48.96 79.29 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.424 -1.47 . . . . 65.24 109.424 171.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.84 -43.99 94.33 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.807 0.803 . . . . 72.13 110.576 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.91 -36.29 83.47 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.5 -0.75 . . . . 54.34 112.012 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -43.85 82.56 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.029 0.831 . . . . 72.1 110.517 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 65.5 t -55.07 -42.09 62.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 123.255 0.622 . . . . 64.51 109.729 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.42 -38.06 56.14 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 121.77 -0.581 . . . . 61.41 111.653 -175.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.45 -28.85 68.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.727 -0.654 . . . . 62.32 110.617 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -75.42 -36.28 60.82 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.925 0.784 . . . . 73.43 110.48 171.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -56.48 -57.74 11.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.976 0.91 . . . . 72.3 111.63 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HE2' HD12 ' A' ' 29' ' ' LEU . 34.0 ttmt -63.54 -30.15 71.31 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.548 0.613 . . . . 71.44 111.46 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -73.83 10.23 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.323 1.449 . . . . 74.03 113.117 -172.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.2 m -112.57 165.98 11.75 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.486 1.514 . . . . 61.32 111.666 -173.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -95.99 105.54 17.59 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 107.713 -1.218 . . . . 71.33 107.713 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.541 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 91.8 mt -92.22 -7.28 48.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.698 -0.683 . . . . 72.14 112.823 -171.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 m -60.29 -27.01 66.95 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.433 1.642 . . . . 61.34 115.433 -169.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -131.72 16.11 4.82 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.344 1.057 . . . . 62.22 111.439 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -64.04 154.28 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.573 1.149 . . . . 51.01 109.966 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -63.64 1.24 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.374 -0.376 . . . . 74.4 110.355 -178.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -127.1 134.76 50.18 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 106.638 -1.616 . . . . 52.4 106.638 166.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.541 ' HE3' ' HB3' ' A' ' 63' ' ' LEU . 29.8 mmtm -59.57 -27.4 66.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.084 0.865 . . . . 61.22 111.051 172.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.7 p -72.66 -53.08 12.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.473 0.709 . . . . 70.44 110.398 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.96 -38.91 65.47 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.8 0.44 . . . . 64.2 111.425 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -60.05 -51.78 68.17 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.732 0.777 . . . . 65.41 109.531 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.9 tp -62.17 -52.07 65.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.705 -0.85 . . . . 73.32 108.705 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 11.9 t -57.65 -28.22 63.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.03 0.932 . . . . 62.24 111.448 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.43 -49.6 50.21 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 111.16 -0.776 . . . . 30.12 111.16 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.94 -37.85 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 117.826 0.813 . . . . 74.13 111.254 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.2 mtt -55.21 -44.83 75.76 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.0 -1.063 . . . . 64.2 111.09 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -58.5 -50.68 72.86 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.01 0.924 . . . . 73.41 110.723 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 t -68.63 -36.35 78.51 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.605 -1.188 . . . . 63.54 111.112 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -65.23 -31.11 72.1 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 122.245 2.293 . . . . 63.2 112.798 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 mmm-85 -69.52 -28.19 65.82 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 121.173 -0.954 . . . . 73.5 111.279 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 . . . . . 0 C--O 1.241 0.65 0 C-N-CA 125.857 1.663 . . . . 63.43 110.471 -176.846 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.552 0 N-CA-C 110.564 -1.014 . . . . 55.55 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.55 -179.97 7.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.675 1.226 . . . . 75.22 110.476 174.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -28.97 67.13 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 114.733 -1.121 . . . . 74.03 112.219 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -52.71 -31.35 37.22 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.865 1.266 . . . . 60.35 112.86 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.4 -42.82 74.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.264 0.626 . . . . 74.25 110.948 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -64.27 -46.44 83.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.279 1.031 . . . . 73.21 111.999 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -70.24 -30.36 67.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.022 0.828 . . . . 70.25 110.365 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.58 -47.87 79.73 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 120.86 -1.15 . . . . 63.22 109.505 172.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 15' ' ' GLN . 29.0 mt -65.25 -15.04 62.06 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.928 0.891 . . . . 61.11 113.175 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -87.88 -42.14 12.72 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.501 1.92 . . . . 44.15 110.431 174.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.16 15.81 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.684 2.794 . . . . 74.14 112.902 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.35 12.33 84.66 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 127.174 2.321 . . . . 54.21 112.641 175.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.8 mt -85.71 145.98 42.84 Favored Pre-proline 0 C--O 1.237 0.417 0 CA-C-N 118.424 1.112 . . . . 41.41 108.908 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -71.02 167.75 25.18 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.578 2.186 . . . . 53.45 112.478 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.504 ' HA ' HD21 ' A' ' 9' ' ' LEU . 46.6 tt0 -70.84 -48.07 55.93 Favored 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 124.974 1.309 . . . . 70.33 110.053 -174.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -62.45 -40.15 95.67 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 119.457 -0.897 . . . . 50.41 111.107 -172.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 76.6 t -60.53 -57.07 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.178 -1.045 . . . . 72.15 108.178 172.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.72 -42.1 62.02 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.411 1.085 . . . . 61.03 113.55 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.12 -52.34 64.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.96 0.904 . . . . 73.51 110.566 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -28.58 62.34 Favored 'General case' 0 N--CA 1.461 0.085 0 O-C-N 121.694 -0.629 . . . . 74.24 110.144 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.541 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -68.23 -35.24 77.65 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.731 0.696 . . . . 74.23 111.28 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -53.03 -43.43 66.57 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.731 1.213 . . . . 64.45 111.57 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -64.57 -15.34 60.89 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 125.633 1.573 . . . . 72.55 113.883 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -76.5 -42.52 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.921 -1.14 . . . . 71.42 107.921 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.541 ' CE2' HD23 ' A' ' 21' ' ' LEU . 53.2 m-85 -84.39 -10.47 57.53 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 113.586 0.958 . . . . 74.32 113.586 -172.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.4 t -86.59 -19.92 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 119.081 0.855 . . . . 72.34 110.576 170.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.64 7.26 30.71 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.272 -0.893 . . . . 61.41 113.371 -165.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.19 5.55 48.95 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.31 -0.869 . . . . 54.34 113.848 -175.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -77.1 -61.08 2.1 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.805 1.302 . . . . 62.21 109.15 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.14 -174.25 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 123.664 0.785 . . . . 63.13 110.634 176.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -124.65 154.96 39.96 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.499 2.32 . . . . 73.41 107.585 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -57.91 -19.47 30.04 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.699 1.0 . . . . 72.35 113.699 -174.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -104.41 15.35 28.38 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.832 -1.167 . . . . 64.43 111.871 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -67.41 -18.48 65.13 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.92 -1.737 . . . . 71.22 114.228 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 70' ' ' SER . 85.2 mt -90.58 167.81 12.27 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.703 0.801 . . . . 75.32 111.59 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.97 156.84 17.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.629 -1.619 . . . . 55.45 106.629 171.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -64.35 -30.02 71.08 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.564 -0.71 . . . . 70.44 110.27 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -55.12 -22.48 16.83 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.446 1.098 . . . . 64.25 113.611 170.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -92.94 -44.52 8.4 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.004 1.322 . . . . 73.35 110.925 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.25 -42.53 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 119.146 0.885 . . . . 43.11 109.36 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -51.09 -49.3 60.96 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.498 1.119 . . . . 74.22 111.135 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.8 92.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.903 0.481 . . . . 63.02 110.092 -172.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 mt -58.44 -34.19 70.55 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.598 0.592 . . . . 73.12 112.598 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -60.54 -26.99 67.3 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 119.126 -0.464 . . . . 71.31 111.54 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -80.13 -18.19 50.5 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.81 1.041 . . . . 72.21 113.81 -168.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -87.12 155.41 20.13 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.008 1.323 . . . . 72.35 110.006 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -79.56 -177.66 5.93 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.273 1.429 . . . . 74.11 110.397 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -52.14 -70.86 0.08 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.109 1.764 . . . . 73.54 110.492 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -60.92 -45.59 94.05 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 124.886 1.275 . . . . 75.45 109.994 -174.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.564 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -55.78 -54.7 33.22 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 110.207 -1.157 . . . . 52.01 110.207 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.57 76.32 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.882 0.841 . . . . 65.45 110.672 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.61 -41.54 66.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.207 1.003 . . . . 75.41 110.815 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.98 79.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.882 0.31 . . . . 74.13 110.505 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 50' ' ' GLY . 11.0 t -58.97 -34.99 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 124.474 1.109 . . . . 74.54 110.471 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.9 -43.24 83.91 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.498 0.719 . . . . 75.21 109.985 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -43.97 92.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.122 -1.436 . . . . 72.23 107.122 -177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -76.3 -33.71 59.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.488 -0.56 . . . . 62.41 109.488 -168.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -60.15 -62.7 1.68 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.471 1.108 . . . . 72.35 110.785 171.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -44.54 62.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.967 1.707 . . . . 74.43 111.701 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.22 15.05 0.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.852 1.261 . . . . 74.21 113.47 -173.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.7 m -112.53 173.68 6.26 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.478 1.511 . . . . 52.03 111.383 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -103.41 123.94 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.498 -1.667 . . . . 63.51 106.498 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.8 mt -105.68 -9.55 17.26 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 125.256 1.423 . . . . 74.21 112.242 -171.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.5 m -56.68 -26.81 57.43 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.717 2.007 . . . . 75.32 114.637 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -122.91 11.57 9.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.573 1.149 . . . . 72.42 110.924 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.7 t -71.38 127.83 33.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 O-C-N 120.891 -1.13 . . . . 75.33 108.205 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -64.29 -56.73 12.51 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.136 1.775 . . . . 52.43 110.379 -175.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -128.77 126.01 39.05 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 105.291 -2.114 . . . . 75.33 105.291 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -60.96 -27.78 68.5 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.558 0.536 . . . . 73.43 111.629 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . 0.402 ' HB3' ' HA ' ' A' ' 35' ' ' LEU . 12.4 p -73.77 -54.05 8.92 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.127 2.171 . . . . 73.43 110.81 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.01 64.69 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 118.356 0.525 . . . . 71.32 111.984 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -67.21 -46.5 73.68 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 120.603 0.24 . . . . 61.22 110.535 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -62.54 -42.88 99.81 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.811 0.444 . . . . 73.35 110.171 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.64 -28.4 63.67 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.14 -0.933 . . . . 72.52 112.557 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.6 -55.98 6.33 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.356 0.979 . . . . 21.52 111.907 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 22.4 t -62.05 -39.97 85.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 118.023 0.911 . . . . 71.53 109.863 -173.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 28.7 mtm -57.21 -42.1 80.7 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.483 -1.385 . . . . 61.34 111.491 172.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -61.76 -38.86 89.58 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 121.79 -0.569 . . . . 74.12 110.654 -177.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -50.89 61.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.371 -0.823 . . . . 72.24 110.515 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.556 ' CG ' HG22 ' A' ' 54' ' ' VAL . 11.5 m-85 -54.22 -32.68 56.46 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.557 0.947 . . . . 72.53 113.557 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -13.53 61.24 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 114.227 1.195 . . . . 72.21 114.227 175.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.237 0.419 0 C-N-CA 125.053 1.341 . . . . 73.11 108.497 179.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.698 0 N-CA-C 110.287 -1.125 . . . . 61.02 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -119.43 178.9 4.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.555 0.742 . . . . 61.31 110.845 177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -31.98 46.18 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.726 1.211 . . . . 75.42 113.769 -176.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -57.85 -33.9 69.15 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.358 1.063 . . . . 63.34 111.739 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -52.84 -56.72 13.74 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.298 1.039 . . . . 75.41 111.657 -172.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -57.93 -32.33 67.68 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.636 0.775 . . . . 75.1 111.536 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.0 m -67.18 -33.64 75.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 117.917 -1.039 . . . . 73.21 110.907 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.623 ' HG ' HD22 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -62.48 -39.81 94.64 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.698 2.044 . . . . 73.24 110.189 175.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.9 mm? -66.51 -16.56 64.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.502 0.721 . . . . 71.41 112.076 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -93.51 -39.4 10.89 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.498 1.919 . . . . 72.32 109.728 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.417 ' O ' ' HE2' ' A' ' 44' ' ' LYS . . . -70.35 8.0 0.9 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 129.805 3.242 . . . . 72.13 112.913 -174.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 109.47 -0.37 30.9 Favored Glycine 0 N--CA 1.439 -1.158 0 C-N-CA 124.979 1.276 . . . . 73.13 113.577 172.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -105.3 154.76 38.71 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 119.275 1.537 . . . . 72.0 112.329 -162.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -78.63 172.76 14.65 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.066 2.51 . . . . 62.41 111.789 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.459 ' HA ' HD11 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -74.24 -42.46 59.67 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 118.219 -0.896 . . . . 62.04 110.712 -174.09 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -64.72 -41.62 95.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 118.732 -1.187 . . . . 64.44 110.565 -167.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.9 t -58.07 -56.46 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 125.59 1.556 . . . . 55.1 108.739 168.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -37.16 67.85 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.037 0.754 . . . . 53.52 113.037 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.426 ' C ' ' HE3' ' A' ' 20' ' ' LYS . 3.8 mt-10 -63.33 -20.66 65.7 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.264 1.026 . . . . 73.02 112.744 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HE3' ' C ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -98.25 -32.48 11.54 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.23 0.923 . . . . 74.24 110.46 170.127 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.731 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -68.17 -31.67 71.38 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 125.116 1.366 . . . . 64.32 111.129 -175.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -54.52 -51.17 65.98 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 126.193 1.797 . . . . 71.22 112.033 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.91 -34.52 28.76 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.672 2.389 . . . . 52.22 112.503 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.9 mt -63.42 -28.17 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 108.447 -0.946 . . . . 73.42 108.447 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.731 ' HE2' HD23 ' A' ' 21' ' ' LEU . 34.6 m-85 -104.42 13.11 32.52 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.804 1.642 . . . . 74.14 112.805 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -111.06 -36.18 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.306 1.042 . . . . 73.21 109.912 173.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.93 9.62 3.45 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.009 -1.057 . . . . 74.15 112.981 -174.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.03 11.46 66.89 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 118.999 -0.889 . . . . 64.35 113.147 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.495 HD12 ' HE2' ' A' ' 59' ' ' LYS . 88.6 mt -66.12 -65.85 0.62 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.522 1.161 . . . . 61.45 108.121 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.424 HG23 ' CE1' ' A' ' 25' ' ' TYR . 27.3 m -135.45 164.02 34.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 O-C-N 123.238 0.336 . . . . 75.42 111.213 -173.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -90.15 155.2 19.2 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.208 1.003 . . . . 75.41 110.269 175.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -63.01 -23.81 67.63 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.259 -0.901 . . . . 63.34 112.209 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -100.5 12.88 36.32 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.76 1.022 . . . . 73.32 113.76 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.22 -26.35 62.0 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.601 -1.312 . . . . 75.44 112.579 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.9 mt -76.51 156.57 32.84 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.381 0.672 . . . . 71.35 110.835 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -110.25 173.59 6.26 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.834 1.653 . . . . 73.03 108.996 171.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -35.76 75.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 75.31 111.322 -164.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -66.02 -20.43 66.18 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 118.504 -0.76 . . . . 75.31 111.975 -176.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.64 18.52 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.309 0.959 . . . . 72.44 110.797 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.3 mm -67.09 -38.94 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 108.344 -0.984 . . . . 72.04 108.344 174.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -61.59 -45.56 93.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.481 -0.762 . . . . 74.32 110.473 172.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.13 -42.85 95.68 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.273 -0.394 . . . . 64.03 111.48 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.82 -49.08 74.23 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.978 0.911 . . . . 74.41 111.447 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -53.23 -19.53 3.21 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.818 1.647 . . . . 72.12 113.931 178.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.57 -20.36 26.55 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 120.168 1.349 . . . . 75.31 114.224 -170.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -90.0 152.38 21.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.141 0.976 . . . . 71.05 111.127 -165.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -74.03 -175.51 2.22 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.486 -1.234 . . . . 74.01 110.337 164.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -53.37 -68.0 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 124.71 1.204 . . . . 75.03 112.089 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -72.04 -35.3 69.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.086 -0.709 . . . . 73.41 109.086 -173.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.99 -46.12 70.02 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 110.93 -0.868 . . . . 75.12 110.93 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.17 -51.53 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 118.365 -0.826 . . . . 75.33 109.686 177.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.07 -43.45 70.29 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.01 0.924 . . . . 74.41 111.478 -178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.406 1.082 . . . . 70.01 111.027 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 89.6 t -57.69 -44.31 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 109.434 -0.58 . . . . 74.33 109.434 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -69.14 -49.12 59.84 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 123.487 0.715 . . . . 64.25 109.285 -173.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -51.35 -60.41 3.15 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 127.154 2.181 . . . . 61.11 108.298 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -63.86 -35.48 80.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.188 0.518 . . . . 71.23 110.649 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -66.53 -55.78 13.92 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.856 0.862 . . . . 71.34 110.891 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE2' HD12 ' A' ' 29' ' ' LEU . 2.0 ttmm -64.29 -29.71 70.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.777 0.831 . . . . 71.25 111.997 177.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -76.55 33.81 0.14 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.694 1.997 . . . . 65.53 111.299 172.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -140.93 171.57 13.89 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.645 2.378 . . . . 64.34 109.768 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -119.83 121.12 38.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.743 2.017 . . . . 64.45 106.696 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 22.1 mt -112.72 7.77 18.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.816 1.647 . . . . 75.05 112.213 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.4 t -58.67 -30.93 67.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.674 1.59 . . . . 71.01 111.724 -173.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -120.39 41.92 3.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 124.296 1.038 . . . . 75.04 109.424 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.6 t -129.74 111.05 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 124.37 1.068 . . . . 74.01 108.477 171.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -57.34 -64.28 0.94 Allowed 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.52 0.728 . . . . 75.44 109.571 171.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -81.25 89.36 6.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.831 0.824 . . . . 74.24 109.988 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -61.74 -37.01 82.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.615 -0.72 . . . . 75.13 111.112 178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 p -61.94 -56.28 20.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 124.656 1.182 . . . . 64.45 108.715 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.48 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . . . -63.01 -20.7 65.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.023 1.12 . . . . 40.55 114.023 -174.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -73.98 -56.37 5.03 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.641 -0.874 . . . . 64.03 108.641 174.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.664 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.9 OUTLIER -60.68 -48.51 81.48 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 125.077 1.351 . . . . 62.31 109.36 -172.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 71' ' ' ALA . 1.7 p -59.16 -30.58 68.27 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.198 -1.365 . . . . 72.24 109.443 -175.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.2 -45.36 71.34 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 125.039 1.304 . . . . 43.51 111.818 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.3 t -57.5 -40.79 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 118.964 1.382 . . . . 71.41 109.544 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.664 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -62.72 -36.18 82.16 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.828 -1.17 . . . . 74.22 110.931 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.0 tttp -62.69 -56.89 13.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.033 -0.729 . . . . 54.34 109.033 -176.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.94 -51.48 61.26 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.244 -0.884 . . . . 63.14 108.98 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.47 -33.84 73.17 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 115.355 1.613 . . . . 75.13 115.355 -173.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.12 -10.22 59.75 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.539 0.609 . . . . 75.03 111.22 177.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 . . . . . 0 N--CA 1.447 -0.597 0 C-N-CA 126.947 2.099 . . . . 42.45 109.333 -175.452 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.665 0 N-CA-C 111.439 -0.664 . . . . 75.5 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.35 179.38 7.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 122.562 1.172 . . . . 42.11 109.891 168.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -52.35 -31.8 35.29 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.612 2.365 . . . . 75.1 113.776 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -66.11 -34.73 78.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.12 0.568 . . . . 64.31 109.87 -172.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -45.12 -54.12 7.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.879 1.671 . . . . 73.15 111.998 -176.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -70.27 -39.69 74.79 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 112.199 0.444 . . . . 73.23 112.199 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.8 m -66.43 -34.42 77.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.115 0.566 . . . . 72.21 110.389 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.03 -48.22 77.16 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.293 -0.879 . . . . 75.54 110.308 171.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 21.8 mt -60.32 -21.38 61.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.928 0.891 . . . . 75.34 112.0 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -81.85 -28.38 33.06 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.286 0.634 . . . . 71.52 110.917 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.28 11.27 1.99 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.208 1.403 . . . . 64.34 112.11 -167.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.06 5.36 53.29 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 124.465 1.031 . . . . 71.23 112.48 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.8 mt -97.51 145.44 29.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 118.267 1.034 . . . . 62.41 111.022 -165.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.87 179.58 3.13 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 125.187 3.925 . . . . 72.23 112.72 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -54.91 8.83 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 120.567 -1.333 . . . . 75.43 109.026 172.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -65.39 -31.97 73.35 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 113.369 0.877 . . . . 74.21 113.369 -160.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.4 t -74.68 -54.09 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.738 -1.208 . . . . 72.25 107.738 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.17 -35.88 38.34 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.929 1.292 . . . . 51.32 112.033 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -36.14 68.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.098 0.959 . . . . 73.12 112.585 177.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.46 -34.96 16.25 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.082 -1.011 . . . . 74.23 110.16 172.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.546 HD12 HD21 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -73.19 -25.05 60.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.629 1.171 . . . . 64.52 112.715 -168.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -56.68 -47.6 79.49 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.071 0.948 . . . . 75.51 110.761 175.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.94 -30.45 64.03 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.939 1.695 . . . . 64.44 112.144 -174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.3 mt -64.58 -31.62 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.834 0.853 . . . . 44.34 109.328 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.482 ' HE2' HD23 ' A' ' 21' ' ' LEU . 81.2 m-85 -85.94 -21.73 27.77 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.506 0.558 . . . . 63.52 112.506 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 64.1 t -65.91 -50.94 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 118.694 0.679 . . . . 70.22 110.472 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.424 ' HB3' ' CD1' ' A' ' 29' ' ' LEU . . . -75.63 -7.25 53.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.628 0.771 . . . . 73.44 112.995 -161.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 80.93 29.66 41.33 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.637 -0.664 . . . . 61.51 112.398 -170.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.478 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.3 mt -76.34 -44.85 34.81 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-N 117.848 0.824 . . . . 73.12 109.411 173.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.3 m -144.96 149.38 16.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 118.256 0.48 . . . . 73.34 110.953 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.39 147.18 38.21 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.674 -0.861 . . . . 74.14 108.674 160.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -62.66 -43.62 98.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.944 -0.472 . . . . 74.43 110.161 171.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.6 m -79.89 19.56 0.68 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.085 0.772 . . . . 75.33 113.085 172.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.93 -42.47 48.72 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 120.319 1.418 . . . . 75.22 108.758 157.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -62.45 131.56 49.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.733 0.813 . . . . 71.34 110.054 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.86 170.1 10.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.719 1.207 . . . . 74.4 109.712 169.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.07 -30.56 62.16 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.046 1.338 . . . . 75.31 112.307 -173.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.48 -37.36 78.03 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.369 0.668 . . . . 63.41 110.928 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.82 34.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.632 0.773 . . . . 42.41 111.125 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.8 mm -58.71 -49.06 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.683 0.793 . . . . 72.54 109.183 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -55.63 -56.7 17.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.154 1.382 . . . . 61.23 109.76 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.56 75.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.724 0.809 . . . . 61.54 111.774 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mt -57.86 -38.01 74.92 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 113.007 0.743 . . . . 74.44 113.007 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.94 -32.89 74.82 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.566 0.621 . . . . 63.44 111.506 174.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -73.73 -15.6 61.21 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.006 0.743 . . . . 63.41 113.006 -171.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -89.18 132.85 34.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 119.076 0.853 . . . . 75.32 110.502 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -65.03 175.33 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.263 -1.335 . . . . 73.52 111.749 166.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -48.32 -64.07 0.9 Allowed 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.935 2.094 . . . . 74.52 111.788 -176.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.71 -36.69 57.03 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 122.831 0.452 . . . . 60.25 110.887 -175.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.61 -36.33 93.21 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 111.182 -0.767 . . . . 34.23 111.182 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.78 61.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.168 0.987 . . . . 53.02 109.911 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.09 -39.02 77.53 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.204 0.456 . . . . 75.25 110.286 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.42 91.89 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.292 0.637 . . . . 35.23 111.762 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -54.31 -44.35 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 109.42 -0.585 . . . . 75.12 109.42 173.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.546 HD21 HD12 ' A' ' 21' ' ' LEU . 19.9 mt -70.28 -47.05 62.94 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.339 -0.986 . . . . 72.41 108.339 -169.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -56.58 -56.17 24.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.46 1.504 . . . . 64.13 110.242 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -62.58 -41.0 98.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.408 1.099 . . . . 73.1 109.66 -174.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.66 -49.68 75.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 125.184 1.394 . . . . 75.42 110.797 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.478 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -71.39 -28.89 64.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.965 -1.084 . . . . 72.31 113.415 -179.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -75.73 -1.09 23.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.253 0.621 . . . . 72.22 111.463 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 m -83.77 172.05 12.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.585 1.539 . . . . 72.0 109.63 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -117.48 91.37 3.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.21 1.004 . . . . 71.33 110.301 -171.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.9 mt -79.99 -2.81 45.69 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.081 0.952 . . . . 62.32 113.417 -166.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.7 t -47.96 -60.92 2.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.174 1.79 . . . . 45.4 110.56 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -88.05 31.15 0.8 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.294 1.038 . . . . 73.32 111.899 -172.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -123.03 120.75 61.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 106.77 -1.567 . . . . 74.34 106.77 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -73.05 -51.01 19.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.874 0.87 . . . . 71.34 109.23 175.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -106.71 80.97 1.51 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 127.192 2.197 . . . . 72.53 108.195 -160.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -51.76 -37.4 51.15 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.262 -1.336 . . . . 74.24 111.251 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.9 p -64.08 -56.4 15.22 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 124.203 1.001 . . . . 73.24 109.824 -173.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.77 -36.34 72.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.33 0.652 . . . . 53.3 111.053 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.26 -53.82 46.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.69 -0.804 . . . . 71.1 109.499 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.59 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -60.47 -53.84 52.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.338 1.455 . . . . 44.24 109.598 -175.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.424 ' N ' HD13 ' A' ' 73' ' ' LEU . 8.1 t -62.0 -31.64 72.03 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.009 -0.996 . . . . 60.42 110.105 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.0 -49.22 68.31 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 118.932 -0.926 . . . . 62.34 111.411 169.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -59.18 -47.08 91.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 118.517 1.159 . . . . 63.2 109.527 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.59 ' CE ' HD11 ' A' ' 73' ' ' LEU . 35.3 mtt -53.41 -47.5 69.53 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.69 -0.631 . . . . 74.13 110.53 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -58.8 -45.48 89.8 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.838 -0.601 . . . . 75.53 110.049 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -47.05 86.79 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.852 0.751 . . . . 62.11 110.556 174.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -60.3 -42.94 96.58 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 113.056 0.762 . . . . 75.42 113.056 -177.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -69.02 -11.01 60.4 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.815 0.734 . . . . 72.52 111.339 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 . . . . . 0 N--CA 1.438 -1.049 0 C-N-CA 125.427 1.491 . . . . 73.51 110.107 -175.665 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.563 0 CA-C-O 121.253 0.363 . . . . 54.31 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.86 -173.95 4.87 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.575 1.95 . . . . 64.13 109.276 163.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.1 pm0 -77.33 -26.32 51.98 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 120.733 -1.229 . . . . 55.45 112.918 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -58.47 -20.49 45.78 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.281 0.946 . . . . 63.12 113.16 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -48.61 -46.89 40.18 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.526 1.131 . . . . 75.24 112.266 -176.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -65.99 -40.06 90.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.876 0.47 . . . . 75.13 111.5 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.2 m -59.9 -37.93 80.82 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.986 0.914 . . . . 75.44 110.31 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -72.27 -44.16 63.21 Favored 'General case' 0 CA--C 1.52 -0.194 0 C-N-CA 123.947 0.899 . . . . 52.25 111.253 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.67 -26.35 44.22 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.787 0.835 . . . . 62.01 111.351 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.96 -17.79 39.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.783 0.833 . . . . 74.43 112.632 -178.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.04 19.78 5.44 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.255 1.422 . . . . 73.22 113.72 -161.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.95 23.8 75.48 Favored Glycine 0 CA--C 1.525 0.667 0 O-C-N 121.577 -0.702 . . . . 54.43 112.512 -173.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.1 mt -112.06 146.17 34.28 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 124.959 1.304 . . . . 71.42 109.173 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.05 165.84 31.06 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.508 2.139 . . . . 62.13 111.09 177.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -60.17 -41.31 92.6 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.683 0.793 . . . . 73.45 108.891 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -58.02 -44.69 87.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.446 -0.797 . . . . 74.44 111.718 -171.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.4 t -70.94 -48.97 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.557 -1.275 . . . . 74.25 107.557 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.54 67.85 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.106 0.78 . . . . 72.25 113.106 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -50.35 -41.04 50.88 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.333 1.453 . . . . 75.14 113.893 172.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.52 -24.28 19.69 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 118.507 -0.759 . . . . 74.21 112.165 177.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.01 -34.52 43.93 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 118.962 0.801 . . . . 73.22 111.088 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -57.09 -41.35 78.71 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.872 0.844 . . . . 73.05 111.164 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -27.71 52.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 127.886 2.474 . . . . 74.22 112.446 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.464 HD13 ' HE3' ' A' ' 59' ' ' LYS . 23.3 mm -71.51 -37.3 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 N-CA-C 107.726 -1.213 . . . . 71.03 107.726 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -83.03 -10.52 58.7 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.454 1.102 . . . . 75.02 112.471 -176.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.3 t -73.77 -42.73 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 O-C-N 121.213 -0.929 . . . . 63.02 109.803 171.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.88 37.1 2.64 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.726 0.81 . . . . 53.54 112.152 -144.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.01 18.63 57.74 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 124.954 1.264 . . . . 74.34 115.085 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.2 mt -85.12 -65.78 0.97 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.348 1.074 . . . . 71.01 109.165 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.3 m -139.39 166.54 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.823 1.249 . . . . 74.23 110.369 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.49 162.93 12.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.234 1.413 . . . . 51.41 108.558 156.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -58.32 -35.36 71.76 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.847 0.748 . . . . 72.53 110.604 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.1 p -81.69 -5.31 57.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.537 1.135 . . . . 63.55 112.303 -174.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.61 -16.93 46.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.866 0.757 . . . . 63.41 112.471 -169.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -90.61 -175.24 4.36 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.133 1.773 . . . . 71.43 110.55 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -114.02 170.77 8.03 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.213 1.405 . . . . 72.52 109.828 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -46.57 -44.74 18.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.959 1.304 . . . . 72.41 110.608 164.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -64.49 -22.79 67.07 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.774 0.657 . . . . 62.24 112.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.28 -52.49 18.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.138 0.881 . . . . 24.53 109.902 171.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.02 -53.81 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 C-N-CA 125.144 1.377 . . . . 64.14 109.35 -175.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -64.02 -44.64 91.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.613 -0.232 . . . . 74.14 111.372 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.58 -38.52 87.83 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.178 -0.304 . . . . 75.34 110.178 -176.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 mt -52.59 -41.63 63.8 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.604 0.762 . . . . 75.12 111.952 173.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -59.22 -55.13 38.84 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.453 0.57 . . . . 74.42 110.081 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -74.18 -1.19 19.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 116.281 1.956 . . . . 73.31 116.281 -162.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.7 159.27 25.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.127 0.971 . . . . 74.33 110.309 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.7 p-10 -75.77 -179.65 4.9 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.185 0.994 . . . . 52.32 109.426 159.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -44.77 -70.87 0.09 Allowed 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 126.978 2.111 . . . . 75.24 110.722 171.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.26 -28.97 60.03 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 112.072 0.397 . . . . 75.05 112.072 -166.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.64 -40.44 94.04 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 110.416 -1.074 . . . . 62.45 110.416 174.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.75 -49.29 76.99 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.48 -0.771 . . . . 75.13 110.374 171.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.46 -38.85 72.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.589 1.086 . . . . 75.43 111.309 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -50.45 73.95 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.783 1.233 . . . . 71.35 111.069 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 63.2 t -52.28 -42.19 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.316 0.647 . . . . 72.25 110.141 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -71.49 -45.64 61.95 Favored 'General case' 0 CA--C 1.516 -0.345 0 O-C-N 122.345 -0.222 . . . . 60.33 110.414 -169.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -54.05 -56.86 14.01 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.88 1.272 . . . . 64.01 108.935 173.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -70.56 -6.68 38.26 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.099 0.777 . . . . 74.24 113.099 -168.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -93.87 -38.91 10.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.027 1.731 . . . . 74.15 111.701 174.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE3' HD13 ' A' ' 24' ' ' ILE . 4.9 mmtt -60.49 -35.27 75.53 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.64 1.109 . . . . 75.25 109.579 165.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -79.46 46.51 0.75 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.904 1.682 . . . . 64.02 109.077 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.2 m -153.76 167.07 30.84 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.304 -1.498 . . . . 74.42 111.705 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -99.78 116.33 31.62 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 126.529 1.932 . . . . 72.41 106.416 175.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.8 mt -114.03 8.7 17.16 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 126.589 1.956 . . . . 53.35 109.92 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 m -75.27 -58.82 3.05 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 126.978 2.111 . . . . 75.24 108.775 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -78.03 0.67 23.64 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 113.34 0.867 . . . . 75.35 113.34 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 48.9 t -82.7 141.25 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 120.937 -1.102 . . . . 60.14 109.819 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -69.13 0.54 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.428 1.491 . . . . 35.43 110.282 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -111.42 100.93 9.43 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 127.34 2.256 . . . . 73.45 107.912 -163.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -60.64 -31.98 71.17 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.495 1.118 . . . . 73.12 112.83 -165.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -57.0 -49.17 76.6 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.848 1.659 . . . . 74.15 108.757 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.12 -5.63 36.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 113.458 0.91 . . . . 20.33 113.458 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -91.0 -56.33 3.21 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 119.872 -0.731 . . . . 72.41 109.38 163.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.678 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -62.26 -50.8 70.27 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 126.117 1.767 . . . . 52.32 109.674 -165.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.7 t -55.09 -36.16 65.36 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.239 -1.346 . . . . 71.23 109.473 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.95 -42.04 97.06 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.002 -0.888 . . . . 73.14 112.7 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.7 t -60.53 -46.35 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 119.097 1.449 . . . . 54.22 108.653 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.678 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -58.54 -40.44 83.02 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.604 -0.685 . . . . 74.15 109.995 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -53.75 54.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.485 -0.769 . . . . 61.31 110.963 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -63.05 -42.94 99.84 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.7 -0.667 . . . . 63.25 109.788 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -60.09 -38.04 81.76 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.742 1.61 . . . . 75.04 112.523 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -21.33 59.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.592 0.757 . . . . 72.45 110.242 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 . . . . . 0 CA--C 1.54 0.587 0 C-N-CA 126.263 1.825 . . . . 72.35 111.423 -177.001 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.794 0 N-CA-C 111.384 -0.686 . . . . 72.0 111.384 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -96.36 -167.77 1.63 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.552 1.141 . . . . 75.42 110.28 166.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.07 -33.22 51.07 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 125.773 1.629 . . . . 71.11 113.264 -175.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.95 -41.93 97.24 Favored 'General case' 0 C--O 1.227 -0.114 0 C-N-CA 124.797 1.239 . . . . 64.44 110.168 -179.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -45.94 -60.93 1.97 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.945 1.698 . . . . 75.14 112.754 -170.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -63.38 -33.41 75.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.223 -0.417 . . . . 41.24 111.494 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.15 -39.61 86.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.462 -0.78 . . . . 73.23 109.364 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.12 96.07 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 120.011 1.278 . . . . 72.4 109.71 174.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.26 -16.81 61.44 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.996 0.918 . . . . 71.24 112.879 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -105.71 -17.79 14.28 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.26 1.824 . . . . 64.0 110.767 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.32 30.29 0.71 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 127.507 2.323 . . . . 74.4 110.813 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.455 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 82.38 3.2 90.63 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-O 117.784 -1.564 . . . . 71.1 114.277 173.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.2 mt -104.29 157.24 34.48 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.939 1.87 . . . . 42.42 112.92 -172.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.67 170.58 19.9 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 124.346 3.364 . . . . 63.3 113.739 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -66.4 -47.63 72.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 124.985 1.314 . . . . 55.13 109.728 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -42.52 86.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.16 0.43 . . . . 72.23 112.16 -166.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.93 -57.12 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 126.791 2.036 . . . . 63.11 107.285 173.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.14 -42.69 63.56 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 124.659 1.184 . . . . 73.14 112.491 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.11 -45.55 71.9 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.04 0.936 . . . . 74.33 110.217 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -38.54 28.07 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 119.289 -0.386 . . . . 75.44 110.6 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.33 -41.38 94.0 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.736 1.215 . . . . 75.02 110.88 -174.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.23 -44.31 75.34 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.885 1.274 . . . . 75.31 110.547 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -33.36 67.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.453 1.101 . . . . 73.44 112.858 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -66.93 -25.25 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.78 0.832 . . . . 64.33 109.483 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.68 -31.84 14.29 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.08 0.952 . . . . 73.41 111.855 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -53.19 -53.47 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.475 0.71 . . . . 74.4 110.883 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 1.75 17.13 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.755 0.65 . . . . 63.12 112.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.08 25.88 72.27 Favored Glycine 0 CA--C 1.528 0.885 0 O-C-N 120.782 -1.199 . . . . 54.54 112.88 174.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.469 HD13 ' HE2' ' A' ' 59' ' ' LYS . 1.8 mp -59.88 -43.88 94.5 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.203 1.501 . . . . 75.14 108.067 168.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -132.01 168.63 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 126.278 1.831 . . . . 75.24 108.224 167.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.97 161.29 13.81 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 107.862 -1.162 . . . . 73.2 107.862 165.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -59.28 -10.22 2.84 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.095 1.517 . . . . 75.23 115.095 -172.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.69 42.86 3.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.101 1.76 . . . . 63.3 109.73 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -74.47 -10.15 59.28 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 127.793 2.437 . . . . 64.24 113.647 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 mt -101.24 158.56 15.95 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 122.958 0.503 . . . . 71.34 112.142 -167.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -91.2 163.2 14.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.999 1.32 . . . . 74.03 109.351 167.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -46.99 -51.94 15.93 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.188 2.195 . . . . 71.42 111.784 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -76.79 -9.27 58.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.362 -0.828 . . . . 75.34 111.353 -172.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.26 -47.59 41.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.197 -1.382 . . . . 73.42 109.387 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.72 -52.09 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 120.597 1.544 . . . . 45.5 109.901 174.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.91 -40.44 88.82 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.969 0.729 . . . . 64.0 112.969 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.2 -23.24 54.65 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.502 1.046 . . . . 72.23 112.67 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.88 -32.03 73.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.16 0.984 . . . . 74.0 110.415 171.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.455 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 1.0 OUTLIER -62.13 -13.18 24.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.819 1.247 . . . . 72.0 112.89 174.13 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -104.85 2.99 30.54 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.047 0.939 . . . . 65.33 112.852 -171.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -97.47 160.25 14.44 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 120.626 -1.297 . . . . 63.24 109.98 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -86.73 178.4 7.03 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.349 1.46 . . . . 73.14 110.107 164.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -52.35 -68.04 0.2 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 127.275 2.23 . . . . 64.23 110.153 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.02 -34.0 77.08 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.92 -0.488 . . . . 75.12 111.781 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.456 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -61.39 -59.5 9.81 Favored Glycine 0 C--N 1.34 0.763 0 N-CA-C 109.616 -1.394 . . . . 52.24 109.616 177.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.86 -45.26 63.99 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.514 0.726 . . . . 71.31 111.891 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.63 -37.35 81.17 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.903 0.774 . . . . 74.41 111.761 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.91 -46.39 74.99 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.561 0.619 . . . . 73.11 110.321 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.521 HG22 ' CD2' ' A' ' 80' ' ' TYR . 10.2 t -57.62 -40.78 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 118.608 0.64 . . . . 73.02 110.747 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.99 -49.07 77.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.421 1.088 . . . . 75.4 109.824 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -57.53 -52.0 67.2 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.373 -0.83 . . . . 63.33 109.107 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -69.83 -26.21 64.12 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.425 0.557 . . . . 74.34 111.633 -170.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -62.14 -67.66 0.39 Allowed 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.951 -1.129 . . . . 73.0 107.951 168.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.469 ' HE2' HD13 ' A' ' 29' ' ' LEU . 4.4 tppp? -48.8 -37.28 18.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.192 0.997 . . . . 71.14 111.583 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -72.75 28.14 0.06 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.229 1.411 . . . . 60.13 112.935 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.8 m -142.27 157.84 44.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.733 1.613 . . . . 54.54 108.989 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.16 79.49 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 124.364 2.03 . . . . 72.33 108.423 -153.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.406 ' O ' ' HE2' ' A' ' 69' ' ' LYS . 70.0 mt -72.57 -0.2 12.19 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 127.24 2.216 . . . . 74.41 115.187 -165.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.4 t -56.4 -45.6 80.56 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.8 1.182 . . . . 74.43 111.368 -163.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -106.44 64.08 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.687 -0.857 . . . . 71.0 108.687 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.1 t -131.73 124.92 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 N-CA-C 106.87 -1.53 . . . . 53.33 106.87 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.513 ' H ' ' CD ' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -65.24 -54.27 31.8 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.686 0.794 . . . . 72.24 109.134 178.333 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -115.18 71.88 0.78 Allowed 'General case' 0 C--N 1.335 -0.065 0 C-N-CA 125.669 1.587 . . . . 75.32 110.741 -156.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HE2' ' O ' ' A' ' 63' ' ' LEU . 30.1 mmtp -46.95 -36.8 8.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 127.02 2.128 . . . . 64.11 112.916 178.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.31 -50.53 67.47 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 125.329 1.452 . . . . 62.04 111.077 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.9 71.93 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.967 0.507 . . . . 61.04 110.569 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -57.29 -54.96 40.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.625 -0.88 . . . . 72.2 108.625 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.41 -46.92 87.34 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.699 0.4 . . . . 75.14 110.532 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 33.1 t -53.55 -41.82 66.85 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.651 0.78 . . . . 54.23 110.856 177.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.58 -53.41 43.84 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.969 -0.853 . . . . 73.42 110.969 176.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -57.29 -45.38 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 123.222 0.609 . . . . 63.32 109.386 177.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.3 mtt -55.78 -44.33 77.63 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.969 -1.082 . . . . 74.41 111.717 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -57.16 -53.59 56.41 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 118.792 -0.623 . . . . 71.11 109.453 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 m -58.68 -43.26 89.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.351 0.407 . . . . 55.31 110.848 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.521 ' CD2' HG22 ' A' ' 54' ' ' VAL . 14.4 m-85 -61.92 -38.49 88.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.959 -1.088 . . . . 74.04 112.463 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.72 -11.58 59.84 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.711 -1.243 . . . . 74.02 112.438 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 . . . . . 0 C--O 1.232 0.146 0 C-N-CA 124.815 1.246 . . . . 61.23 109.481 -176.575 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 N-CA-C 109.443 -1.463 . . . . 71.15 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.65 -167.2 1.22 Allowed 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.937 -1.134 . . . . 50.25 107.937 161.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.97 -29.48 70.84 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.714 1.606 . . . . 74.31 112.348 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.46 -36.75 76.56 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.105 0.866 . . . . 73.54 110.264 -171.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -44.39 -53.4 6.86 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.495 1.918 . . . . 74.25 112.495 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.6 tp60 -61.88 -41.93 98.46 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 119.064 -0.493 . . . . 72.25 110.844 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.0 m -67.0 -37.28 83.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.539 -0.541 . . . . 64.14 109.539 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -36.75 82.44 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.281 -0.887 . . . . 63.23 111.295 176.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -23.33 67.22 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.365 0.53 . . . . 64.43 111.084 176.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -87.85 -24.28 23.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.962 0.801 . . . . 72.24 112.08 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.38 11.99 1.38 Allowed 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.101 2.161 . . . . 54.43 112.724 -164.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 16.12 46.29 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-O 117.954 -1.47 . . . . 71.24 114.168 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.7 mt -119.79 157.02 53.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.773 1.286 . . . . 71.45 113.184 -171.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.23 172.49 15.95 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 124.657 3.571 . . . . 72.52 113.178 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -73.45 -43.72 59.72 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.972 1.309 . . . . 74.24 110.278 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.91 -38.48 72.91 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.992 -0.283 . . . . 71.24 111.611 -171.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.3 t -70.74 -52.31 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 127.227 2.211 . . . . 73.34 107.146 176.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.02 -42.25 62.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.889 1.275 . . . . 70.12 112.112 -173.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -52.79 -55.04 25.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 73.53 110.39 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.55 -27.26 58.58 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 118.568 -0.73 . . . . 74.32 111.308 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.3 tp -74.69 -41.63 59.9 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.001 0.92 . . . . 62.33 110.994 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -54.65 -45.97 73.89 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.06 0.944 . . . . 73.53 110.121 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -37.57 28.6 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 126.999 2.12 . . . . 63.44 112.403 176.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.41 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 108.688 -0.856 . . . . 72.11 108.688 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 19.7 m-85 -80.98 -4.03 53.67 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.884 1.274 . . . . 74.13 112.74 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 42.2 t -85.42 -44.49 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.787 1.176 . . . . 75.55 110.752 175.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.83 -4.29 42.84 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.1 0.778 . . . . 72.53 113.1 -162.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.12 -14.84 64.55 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 125.202 1.382 . . . . 62.24 113.179 -176.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.427 HD12 ' HE2' ' A' ' 59' ' ' LYS . 87.9 mt -53.47 -51.66 62.02 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.681 1.593 . . . . 61.42 110.951 -172.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 69' ' ' LYS . 5.8 m -136.47 160.09 37.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 O-C-N 123.532 0.52 . . . . 63.25 111.899 168.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.46 159.68 20.72 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 108.504 -0.924 . . . . 74.43 108.504 156.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.426 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 29.1 p80 -59.97 -31.44 69.9 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.934 -0.555 . . . . 61.43 112.088 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.74 2.05 55.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.373 -0.823 . . . . 73.12 112.331 179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -77.34 15.04 0.81 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.583 1.538 . . . . 54.31 112.694 -177.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 51.3 mt -118.09 -170.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.43 2.692 . . . . 74.15 106.747 -174.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -132.55 172.63 12.25 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 107.48 -1.304 . . . . 74.41 107.48 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -52.76 -36.61 58.22 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.668 0.787 . . . . 63.24 110.825 171.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -54.63 -32.09 58.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.689 -0.632 . . . . 72.51 112.37 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.77 -46.01 22.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.565 0.746 . . . . 61.33 110.963 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.1 mm -55.23 -53.16 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 N-CA-C 107.97 -1.122 . . . . 74.55 107.97 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.43 -45.16 95.49 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 125.102 1.361 . . . . 74.51 110.336 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.58 84.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.329 -0.843 . . . . 74.55 111.918 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.33 -38.83 81.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.239 0.927 . . . . 73.23 111.533 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -61.09 -44.87 96.7 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.145 0.429 . . . . 65.25 109.942 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -69.3 11.99 0.2 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 128.921 2.888 . . . . 73.14 116.1 -165.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -118.33 154.27 32.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.858 1.263 . . . . 62.14 109.55 -175.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.18 176.9 0.1 Allowed 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 122.887 1.327 . . . . 63.1 112.141 155.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -52.23 -65.71 0.51 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.958 2.503 . . . . 70.22 110.313 165.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -32.97 66.51 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.369 0.986 . . . . 50.45 111.973 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.08 -57.24 10.29 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.34 0.971 . . . . 53.25 111.023 168.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.45 -42.87 97.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.659 -0.686 . . . . 74.42 111.297 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.86 -50.26 69.51 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 117.733 -1.127 . . . . 71.54 110.728 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.28 -45.91 69.08 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.632 1.106 . . . . 61.14 111.534 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.41 HG11 ' HG2' ' A' ' 77' ' ' MET . 55.7 t -53.87 -43.12 56.0 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 124.507 1.123 . . . . 74.31 111.556 175.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -72.17 -42.53 65.8 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 122.985 0.514 . . . . 71.44 109.994 -175.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -71.25 -41.09 70.56 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 122.49 0.316 . . . . 75.13 110.834 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -69.31 -17.62 63.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.404 -0.518 . . . . 62.41 111.157 173.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.477 ' CD2' HD23 ' A' ' 73' ' ' LEU . 16.6 t80 -84.95 -41.45 15.89 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-O 119.418 -0.325 . . . . 70.53 110.324 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.427 ' HE2' HD12 ' A' ' 29' ' ' LEU . 6.6 ttmt -70.91 -19.92 62.54 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.881 0.764 . . . . 75.45 111.362 172.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -75.49 48.23 0.43 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.301 1.44 . . . . 71.34 109.753 168.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.4 m -149.58 152.55 35.67 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.629 -1.919 . . . . 71.52 112.411 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -93.37 78.55 4.43 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.271 1.428 . . . . 63.43 107.498 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -79.96 -11.86 59.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.181 -0.918 . . . . 74.22 111.064 -168.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 m -53.1 -30.99 39.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.862 2.065 . . . . 75.22 112.07 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.7 m80 -100.21 14.01 32.31 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.352 1.061 . . . . 64.34 113.862 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.2 t -105.17 135.14 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 121.574 -0.704 . . . . 52.15 109.841 -176.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -68.48 0.32 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.37 1.868 . . . . 61.25 110.534 176.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -111.61 88.92 2.92 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.34 1.456 . . . . 63.45 109.692 -166.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB3' HG12 ' A' ' 30' ' ' VAL . 38.9 mmtm -53.21 -31.6 43.87 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.195 1.398 . . . . 71.44 114.07 -172.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.53 25.92 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 128.473 2.709 . . . . 72.15 109.085 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.12 89.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.495 0.718 . . . . 73.23 110.146 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.97 -51.03 69.71 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.33 -0.619 . . . . 63.52 109.33 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.561 HD21 ' HE3' ' A' ' 77' ' ' MET . 0.2 OUTLIER -62.05 -57.57 11.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.473 1.109 . . . . 70.12 108.622 -175.766 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 2.8 t -62.22 -27.1 68.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.637 -0.71 . . . . 52.43 110.583 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.07 -53.69 40.71 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.855 0.741 . . . . 72.14 111.405 168.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -54.52 -49.26 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 118.285 1.042 . . . . 74.44 108.545 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.561 ' HE3' HD21 ' A' ' 73' ' ' LEU . 18.2 mtt -50.59 -54.04 25.82 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.617 0.767 . . . . 73.41 110.744 177.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -62.56 -43.99 97.44 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.802 -0.444 . . . . 74.55 109.802 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -58.6 -47.5 84.12 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.397 0.679 . . . . 70.22 109.607 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -64.06 -44.01 93.74 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.342 0.519 . . . . 74.53 111.924 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -62.44 -50.74 70.26 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.054 -0.721 . . . . 73.34 109.054 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 . . . . . 0 CA--C 1.535 0.371 0 CA-C-O 122.836 1.303 . . . . 72.3 110.011 172.434 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.88 0 N-CA-C 109.959 -1.256 . . . . 73.53 109.959 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.34 -176.61 3.03 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.919 1.288 . . . . 72.12 109.588 -168.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -50.99 -37.48 45.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.442 1.097 . . . . 74.23 112.459 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -35.27 76.3 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.56 -0.904 . . . . 62.14 108.56 -168.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -44.08 -53.39 6.42 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.896 1.678 . . . . 72.53 111.541 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -66.58 -43.5 84.79 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.861 -0.336 . . . . 61.42 110.664 -175.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.5 m -61.65 -38.59 88.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.25 0.62 . . . . 73.23 109.882 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.85 78.63 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.656 1.583 . . . . 55.32 111.692 178.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.88 -25.49 65.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.344 0.975 . . . . 64.12 110.135 173.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.89 -11.59 26.47 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.411 1.005 . . . . 73.01 111.905 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.15 13.03 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.829 -1.17 . . . . 74.22 112.184 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 106.36 1.89 38.08 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 124.49 1.043 . . . . 51.42 113.622 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.1 mt -100.17 144.84 29.17 Favored Pre-proline 0 N--CA 1.448 -0.563 0 C-N-CA 124.013 0.925 . . . . 74.51 108.688 -160.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' HG23 ' A' ' 17' ' ' VAL . 73.9 Cg_endo -69.61 164.23 35.16 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 121.639 1.559 . . . . 71.24 110.496 176.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -62.46 -46.81 86.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 -178.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -36.91 71.0 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 114.219 1.192 . . . . 75.34 114.219 -174.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . 0.402 HG23 ' HG2' ' A' ' 14' ' ' PRO . 57.4 t -73.96 -52.47 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 107.049 -1.463 . . . . 72.2 107.049 174.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.2 -36.09 51.02 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.381 1.073 . . . . 52.21 112.589 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.62 -56.18 15.05 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.531 0.733 . . . . 62.2 110.738 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.81 -32.88 57.93 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 115.839 -0.618 . . . . 71.33 110.389 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.54 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -71.58 -32.25 67.85 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.451 1.1 . . . . 62.55 111.185 -174.401 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.59 -45.17 85.61 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.006 1.322 . . . . 75.44 111.567 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -27.45 66.66 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.473 1.109 . . . . 75.41 112.975 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.77 -17.23 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.66 -0.65 . . . . 75.54 109.509 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.54 ' HE2' HD23 ' A' ' 21' ' ' LEU . 64.7 m-85 -97.99 -0.96 43.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.644 1.178 . . . . 75.32 113.227 175.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.0 t -84.1 -55.6 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.191 -0.943 . . . . 75.23 109.078 175.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.06 36.42 1.21 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.513 1.525 . . . . 61.12 111.469 -151.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 59.28 27.95 63.7 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.378 1.466 . . . . 63.12 115.156 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.437 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 38.5 mt -85.44 -66.02 0.95 Allowed 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.789 0.836 . . . . 74.54 109.207 176.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.99 161.73 35.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.078 0.551 . . . . 60.41 110.789 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.25 158.6 15.51 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.644 2.378 . . . . 60.14 109.588 158.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -58.17 -31.94 67.73 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.204 0.456 . . . . 75.23 111.911 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.4 t -95.21 10.32 36.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.563 0.745 . . . . 63.23 111.959 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -83.03 -12.12 57.49 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 120.679 -1.263 . . . . 74.42 111.193 169.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.98 179.4 5.97 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.964 2.106 . . . . 51.22 109.91 174.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 p30 -139.34 -175.92 4.35 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.526 1.13 . . . . 62.13 110.373 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -55.73 -36.48 67.3 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.388 -0.82 . . . . 75.02 111.642 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.0 mtm-85 -66.73 -18.71 65.51 Favored 'General case' 0 C--N 1.338 0.076 0 CA-C-O 118.859 -0.591 . . . . 75.15 111.294 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.72 -51.92 11.64 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.491 1.042 . . . . 53.12 109.93 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.4 mm -60.8 -50.44 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.225 1.41 . . . . 75.13 110.372 -173.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.22 -44.07 76.55 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.626 -0.509 . . . . 74.24 109.626 -174.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.88 82.04 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 122.761 0.424 . . . . 64.2 111.748 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.42 -45.86 80.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.466 0.575 . . . . 71.45 111.259 178.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -20.61 66.14 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.098 -0.953 . . . . 73.12 111.733 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.432 ' CD ' HH21 ' A' ' 81' ' ' ARG . 2.1 mt-10 -85.42 43.7 1.04 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.423 1.465 . . . . 71.41 111.876 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -139.79 156.32 46.82 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.961 -1.087 . . . . 73.2 110.053 170.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -84.99 178.13 7.69 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.547 0.739 . . . . 71.44 109.947 165.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -49.41 -56.39 9.81 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.088 1.755 . . . . 71.41 112.04 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -81.41 -34.1 31.78 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.028 -0.42 . . . . 71.42 111.625 -172.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.48 87.07 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 111.544 -0.622 . . . . 71.21 111.544 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.96 69.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.947 1.299 . . . . 73.54 109.567 168.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.8 mt -63.52 -35.27 79.93 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 118.061 -0.971 . . . . 75.11 111.502 -178.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.38 87.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.527 1.058 . . . . 35.51 110.853 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -54.66 -41.64 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 121.618 -0.677 . . . . 64.44 110.444 173.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.7 mt -78.27 -33.19 49.74 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.403 -0.811 . . . . 75.31 110.45 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -54.89 -62.5 1.61 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 107.228 -1.397 . . . . 75.34 107.228 167.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -72.97 -10.06 59.4 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.471 0.915 . . . . 74.42 113.471 -164.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -84.18 -61.31 1.84 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.867 0.867 . . . . 60.32 110.535 172.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 13.4 ttmt -63.79 -30.1 71.23 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.519 1.054 . . . . 74.23 110.573 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -81.88 57.51 3.48 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 124.381 1.073 . . . . 75.31 109.959 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 75.7 m -153.8 177.31 11.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.055 2.142 . . . . 73.43 107.78 161.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -115.75 105.72 13.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.827 2.051 . . . . 74.54 106.614 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.2 mt -94.59 7.25 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.049 0.939 . . . . 71.35 111.985 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.2 m -53.83 126.47 22.3 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.901 -0.777 . . . . 52.05 108.901 165.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 18.5 m80 59.39 10.26 1.75 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.447 1.899 . . . . 72.51 114.869 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.26 135.79 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 107.357 -1.349 . . . . 72.04 107.357 170.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -54.17 -85.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.214 1.806 . . . . 53.42 111.479 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.49 99.96 7.0 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.738 -1.578 . . . . 71.23 106.738 -162.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -62.89 -28.62 70.17 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.586 1.154 . . . . 74.05 111.232 -169.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -51.38 66.64 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.304 1.842 . . . . 52.53 109.26 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.01 -24.41 59.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.736 -0.649 . . . . 73.42 112.085 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -67.07 -56.55 9.57 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 107.053 -1.462 . . . . 64.03 107.053 171.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.689 HD11 ' HE2' ' A' ' 77' ' ' MET . 0.9 OUTLIER -55.73 -52.54 63.56 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.717 1.607 . . . . 64.44 110.118 -173.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 49.5 t -61.96 -28.03 69.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.559 -0.746 . . . . 61.04 110.216 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.67 -47.3 91.24 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.415 -0.803 . . . . 62.13 111.397 173.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.0 t -54.55 -53.68 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 123.944 0.898 . . . . 63.35 109.023 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.689 ' HE2' HD11 ' A' ' 73' ' ' LEU . 2.2 mtt -56.2 -50.1 72.18 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.015 0.526 . . . . 75.04 110.97 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -54.22 -51.0 65.85 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.649 -0.5 . . . . 75.01 109.649 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -54.59 -48.5 72.08 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 124.514 1.134 . . . . 72.43 109.897 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -64.21 -44.11 92.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.183 0.901 . . . . 75.23 112.55 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.432 HH21 ' CD ' ' A' ' 45' ' ' GLU . 3.9 ttt-85 -70.79 -19.42 62.69 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.186 0.903 . . . . 75.21 111.457 178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 C--N 1.329 -0.3 0 CA-C-O 122.823 1.297 . . . . 73.11 108.944 -179.583 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.449 0 N-CA-C 110.595 -1.002 . . . . 61.54 110.595 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -137.11 -167.87 2.18 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.544 -0.539 . . . . 63.53 109.544 -173.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.04 23.52 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.606 -1.309 . . . . 50.43 114.32 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.7 -32.97 9.11 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 127.23 2.212 . . . . 72.45 110.457 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -54.43 -59.38 4.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.516 1.127 . . . . 74.24 112.456 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 tp60 -59.42 -28.8 67.26 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.419 1.088 . . . . 74.21 111.754 -174.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -59.54 -40.52 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.0 0.92 . . . . 62.45 109.509 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.91 -39.38 87.38 Favored 'General case' 0 C--N 1.342 0.27 0 O-C-N 121.672 -0.642 . . . . 64.13 110.97 177.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 15' ' ' GLN . 3.4 mm? -64.41 -20.83 66.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.666 -0.683 . . . . 72.33 110.373 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.55 -6.02 41.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.508 1.123 . . . . 71.43 110.814 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.78 15.27 5.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 119.3 -2.125 . . . . 71.35 112.306 -175.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.94 11.84 64.68 Favored Glycine 0 CA--C 1.526 0.772 0 O-C-N 121.029 -1.044 . . . . 63.53 113.547 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.417 HD11 HD13 ' A' ' 43' ' ' LEU . 61.6 mt -116.06 160.7 34.44 Favored Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 118.861 1.331 . . . . 63.41 113.507 -161.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.14 172.97 12.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.463 2.775 . . . . 61.05 111.557 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.428 ' HA ' HD11 ' A' ' 9' ' ' LEU . 7.9 tt0 -70.54 -48.0 57.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 118.402 -0.809 . . . . 74.21 110.349 169.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -53.91 -36.1 62.37 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.271 0.841 . . . . 70.02 113.271 -163.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -70.67 -55.39 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 C-N-CA 127.889 2.475 . . . . 74.03 107.978 177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.12 -41.09 16.83 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.83 1.252 . . . . 64.41 112.162 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -61.63 -21.52 64.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.957 1.466 . . . . 74.44 114.957 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.93 -21.23 11.24 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.568 0.543 . . . . 61.25 112.343 170.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.97 -28.11 65.27 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.214 1.006 . . . . 74.22 111.449 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -52.08 -45.83 64.94 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.292 1.437 . . . . 70.15 111.7 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -65.1 -27.98 69.13 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 127.288 2.235 . . . . 74.35 114.124 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.597 HG22 HG22 ' A' ' 30' ' ' VAL . 17.1 mm -57.48 -32.94 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.144 -0.687 . . . . 70.14 109.144 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CE1' HG23 ' A' ' 30' ' ' VAL . 68.1 m-85 -82.42 -49.92 9.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.4 1.08 . . . . 71.51 110.088 177.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.6 t -51.74 -41.83 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.495 0.718 . . . . 63.13 112.195 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.2 7.82 3.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.694 1.198 . . . . 71.12 112.113 -171.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.74 -2.27 59.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.119 0.866 . . . . 44.2 113.036 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.424 HD12 ' HE2' ' A' ' 59' ' ' LYS . 59.6 mt -66.61 -52.11 48.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 124.136 0.974 . . . . 70.31 109.353 -172.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.597 HG22 HG22 ' A' ' 24' ' ' ILE . 30.7 m -132.64 162.84 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.721 1.008 . . . . 73.11 113.721 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -99.64 155.68 17.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.412 1.485 . . . . 63.3 109.271 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -70.34 -12.55 61.66 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.466 0.913 . . . . 64.41 113.466 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.3 m -118.63 18.4 13.46 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.576 1.15 . . . . 45.02 111.916 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -68.84 -30.09 68.55 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.311 -0.868 . . . . 71.13 110.228 169.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.07 127.29 32.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.067 1.347 . . . . 73.21 108.902 -175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -83.53 164.08 20.03 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.431 -1.322 . . . . 70.4 107.431 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -44.6 -44.2 8.71 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.067 2.147 . . . . 65.0 113.263 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -51.07 -38.18 50.07 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.876 1.27 . . . . 73.1 113.368 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -84.28 -28.1 27.4 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.111 0.965 . . . . 73.32 111.604 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.0 mm -67.6 -45.24 85.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 109.493 -0.558 . . . . 51.14 109.493 176.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -57.92 -49.09 77.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 109.398 -0.593 . . . . 63.34 109.398 172.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.28 77.59 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 118.756 -0.64 . . . . 73.01 111.419 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 43' ' ' LEU . 4.9 mt -56.64 -51.54 68.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 120.197 1.362 . . . . 74.4 112.688 173.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -58.06 -17.12 15.73 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.565 0.95 . . . . 74.11 113.565 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.64 -20.63 53.49 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 120.517 1.508 . . . . 72.3 114.819 -170.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -94.95 160.93 14.36 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.168 0.985 . . . . 62.43 110.979 -168.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -85.09 178.86 7.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.915 1.286 . . . . 73.24 110.794 166.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -36.54 66.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.72 1.608 . . . . 65.22 113.628 -172.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.13 -34.34 10.79 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.269 1.427 . . . . 74.13 109.929 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.31 -43.49 97.25 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.016 -0.834 . . . . 50.54 111.016 178.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.26 81.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.874 1.27 . . . . 63.3 109.783 173.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 mp -61.96 -30.82 71.18 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.939 0.895 . . . . 74.34 111.727 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.75 82.48 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.312 0.96 . . . . 50.2 111.654 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -55.07 -41.06 57.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 109.134 -0.691 . . . . 64.42 109.134 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.55 -51.29 29.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 118.78 -0.629 . . . . 72.01 110.42 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.62 -20.72 65.9 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.038 0.535 . . . . 74.44 112.41 -174.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -87.68 -40.01 14.52 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.636 0.375 . . . . 64.23 110.937 171.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 73' ' ' LEU . 61.4 t80 -77.16 -36.1 55.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.554 0.946 . . . . 74.13 113.554 -173.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.424 ' HE2' HD12 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -58.18 -37.77 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.711 -1.243 . . . . 71.24 109.218 169.422 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -83.44 2.22 37.74 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.123 2.169 . . . . 71.1 112.112 -173.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m -82.61 152.29 25.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.622 1.201 . . . . 65.22 111.914 174.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -83.29 53.81 2.6 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.439 2.296 . . . . 73.42 109.19 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.44 -0.49 12.68 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.843 1.423 . . . . 74.12 114.843 -163.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.4 m -58.06 -59.71 4.85 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.842 1.201 . . . . 62.3 110.479 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -84.8 53.08 2.59 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.385 1.074 . . . . 65.31 110.389 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.4 t -133.23 121.06 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 106.709 -1.589 . . . . 62.03 106.709 170.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.45 -56.54 4.36 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.29 0.95 . . . . 73.43 109.612 169.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -77.05 72.82 3.62 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.02 1.328 . . . . 71.1 110.705 -172.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -57.79 -39.02 76.54 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.994 -0.441 . . . . 73.2 112.052 -176.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.87 -52.72 55.08 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 127.839 2.456 . . . . 70.22 108.457 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.29 79.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.907 -0.588 . . . . 74.34 110.843 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -62.61 -50.37 71.52 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 109.339 -0.615 . . . . 74.43 109.339 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' CE ' ' A' ' 77' ' ' MET . 1.3 tm? -59.52 -52.06 67.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.938 0.895 . . . . 65.24 109.819 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.8 t -58.36 -37.93 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.306 -0.861 . . . . 72.11 109.502 -177.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.03 -45.04 95.82 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.557 1.075 . . . . 42.2 113.167 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.47 -39.51 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 119.332 1.566 . . . . 71.41 109.587 174.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.648 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.6 mtt -62.72 -35.42 79.7 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.287 -1.508 . . . . 71.42 111.285 176.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 78' ' ' LYS . 15.3 mtpp -62.93 -46.01 89.81 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 118.461 -0.78 . . . . 65.34 111.398 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 t -62.14 -47.85 82.72 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 119.667 1.121 . . . . 71.32 108.414 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -63.81 -32.66 74.24 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.093 1.516 . . . . 73.13 115.093 -170.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -77.94 -29.55 50.02 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.969 1.259 . . . . 74.32 112.308 169.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 . . . . . 0 C--O 1.238 0.464 0 C-N-CA 124.519 1.128 . . . . 74.33 109.122 -171.562 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.352 0 N-CA-C 108.576 -1.81 . . . . 61.03 108.576 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 m -97.89 -170.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 123.696 0.798 . . . . 62.02 110.429 -177.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -61.53 -10.14 7.34 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 114.597 1.332 . . . . 63.5 114.597 -175.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -70.69 -43.21 69.51 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 120.305 1.412 . . . . 74.4 108.679 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -47.02 -56.84 5.74 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.65 1.58 . . . . 73.21 112.622 -173.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -59.99 -42.66 94.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.506 0.323 . . . . 73.32 110.958 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -69.83 -36.88 75.96 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 119.03 -0.51 . . . . 74.31 109.734 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -39.42 91.89 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.744 1.156 . . . . 71.32 111.493 175.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 15' ' ' GLN . 22.1 mt -63.29 -27.47 69.36 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.104 0.561 . . . . 73.11 111.131 176.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -90.94 -29.83 17.22 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.325 0.65 . . . . 75.12 110.965 177.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.68 -15.6 41.53 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.029 2.132 . . . . 60.23 111.661 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.429 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 127.04 4.93 5.86 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-O 117.411 -1.772 . . . . 74.43 114.936 167.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.9 mt -98.78 153.87 37.68 Favored Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 118.795 1.297 . . . . 73.14 111.387 -169.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.48 165.91 29.03 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.932 2.421 . . . . 64.04 111.288 171.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.515 ' HA ' HD21 ' A' ' 9' ' ' LEU . 25.9 tt0 -61.73 -40.37 94.85 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 124.463 1.105 . . . . 64.14 109.981 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -59.01 -51.29 70.71 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 123.913 0.758 . . . . 61.24 110.2 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.5 -50.71 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.904 1.282 . . . . 53.1 107.789 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.37 -41.45 76.24 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.574 0.624 . . . . 74.03 112.373 -176.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.53 -40.19 78.26 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.245 1.018 . . . . 71.41 110.865 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.89 -35.49 32.49 Favored 'General case' 0 C--O 1.231 0.089 0 O-C-N 121.828 -0.545 . . . . 42.42 110.03 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.8 tp -77.52 -36.96 51.92 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.926 -0.559 . . . . 74.4 112.313 -170.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -54.27 -40.9 68.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.773 0.715 . . . . 64.12 111.313 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -58.38 -33.72 69.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 128.32 2.648 . . . . 70.23 111.856 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.7 mm -58.78 -40.13 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 125.039 1.336 . . . . 65.34 109.728 178.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.64 -47.07 16.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.166 0.586 . . . . 73.41 109.98 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 93.1 t -53.68 -46.15 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.678 0.791 . . . . 72.33 111.174 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.74 -1.18 13.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.348 0.87 . . . . 73.12 113.348 -176.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.07 32.23 44.99 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 124.292 0.948 . . . . 21.41 112.355 171.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.59 -85.2 0.07 Allowed 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.826 -1.546 . . . . 72.01 106.826 170.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -103.2 175.92 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.441 1.096 . . . . 71.24 110.194 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.47 15.95 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.785 . . . . 63.31 111.447 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -64.43 -9.1 16.14 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.464 1.105 . . . . 61.53 113.857 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.1 t -124.06 8.79 8.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.213 1.805 . . . . 64.0 110.149 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.9 -15.71 63.12 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.515 0.932 . . . . 74.03 113.515 -167.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -101.55 151.0 22.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.901 0.88 . . . . 63.12 111.75 -159.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -81.95 159.3 23.62 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.246 -1.39 . . . . 35.35 107.246 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.13 -28.85 69.93 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.702 -0.624 . . . . 60.11 112.515 -174.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.367 -0.833 . . . . 74.43 112.261 175.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.33 -30.05 60.18 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.969 -0.382 . . . . 74.24 109.969 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mm -64.99 -53.02 46.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.097 -0.705 . . . . 73.1 109.097 170.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.27 -47.38 84.61 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.237 1.015 . . . . 75.15 111.062 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.13 69.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.05 -0.406 . . . . 75.23 111.7 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.7 mt -56.95 -44.85 82.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.597 0.635 . . . . 63.43 111.816 171.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.429 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.4 OUTLIER -54.46 -20.13 7.01 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.566 1.146 . . . . 72.44 113.509 173.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -79.8 -14.45 58.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 120.363 1.438 . . . . 73.44 112.508 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.9 168.28 12.53 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.739 1.616 . . . . 64.01 109.557 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -96.1 -172.84 2.65 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.293 1.837 . . . . 65.01 109.952 165.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.87 -67.56 0.24 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 127.313 2.245 . . . . 63.24 111.386 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -61.84 -36.76 82.14 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.198 0.599 . . . . 72.03 110.811 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.567 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -50.46 -74.7 0.26 Allowed Glycine 0 C--N 1.338 0.673 0 C-N-CA 124.98 1.276 . . . . 62.43 110.517 172.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.24 -44.02 92.36 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.802 1.241 . . . . 70.24 111.938 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -61.05 -37.25 81.97 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.099 0.959 . . . . 71.13 110.209 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.25 81.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.83 0.741 . . . . 64.33 111.175 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 50' ' ' GLY . 3.2 t -59.02 -23.31 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 CA-C-N 118.791 0.723 . . . . 73.25 111.089 178.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -74.81 -46.5 36.36 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 120.392 -1.442 . . . . 63.34 110.298 174.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.48 60.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.911 0.884 . . . . 74.12 111.549 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.97 -25.97 24.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.746 0.308 . . . . 70.15 111.748 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -66.54 -30.3 70.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.836 0.854 . . . . 73.21 112.295 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -78.03 -25.65 47.97 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.098 -1.001 . . . . 70.42 111.524 167.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.18 45.22 0.73 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.904 1.282 . . . . 45.34 111.437 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.5 m -160.84 178.63 9.23 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 71.23 110.663 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.8 66.72 1.34 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 129.69 3.196 . . . . 53.52 106.579 -146.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.18 7.22 1.04 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.31 1.844 . . . . 74.33 112.861 -167.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 t -68.63 -6.17 24.27 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 128.348 2.659 . . . . 62.3 111.58 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -131.32 38.11 3.65 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.276 1.03 . . . . 71.42 109.984 169.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.56 123.21 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 121.511 0.672 . . . . 61.4 110.042 166.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -80.27 -60.96 2.13 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.141 -0.936 . . . . 74.21 108.906 168.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -80.21 102.94 9.75 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.975 -0.75 . . . . 62.31 108.975 -171.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -73.89 -28.85 61.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.328 -0.851 . . . . 74.41 111.142 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.5 m -66.36 -55.82 14.04 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 124.172 0.989 . . . . 74.4 110.503 -173.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.99 -35.73 77.59 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.726 1.21 . . . . 64.01 110.17 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -63.89 -48.35 76.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.204 0.526 . . . . 75.33 110.611 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.04 -48.94 79.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.63 0.772 . . . . 73.04 110.213 -177.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 3.6 m -55.12 -34.71 63.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.285 1.434 . . . . 74.02 112.307 170.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -60.46 -48.33 86.71 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.145 0.879 . . . . 45.41 111.064 176.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.6 t -61.48 -43.93 97.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 117.548 0.674 . . . . 71.21 109.324 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 31.2 mtt -53.76 -45.51 70.64 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 121.095 -1.003 . . . . 72.15 110.19 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -67.66 -29.51 68.82 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.035 -0.983 . . . . 64.11 112.722 -168.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 15.1 t -72.8 -49.36 31.07 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.351 1.432 . . . . 54.53 108.514 169.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -61.38 -33.53 73.83 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.846 -1.159 . . . . 72.22 113.774 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 -7.16 59.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.341 1.056 . . . . 64.43 112.368 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 . . . . . 0 C--O 1.239 0.533 0 C-N-CA 125.458 1.503 . . . . 72.35 109.303 177.397 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.221 0 N-CA-C 109.981 -1.248 . . . . 73.42 109.981 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 t -140.83 -154.55 0.52 Allowed 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.118 2.567 . . . . 64.44 107.544 -164.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -59.25 -26.37 64.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.161 0.584 . . . . 72.01 111.978 177.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.73 -37.21 67.82 Favored 'General case' 0 C--O 1.227 -0.097 0 CA-C-N 118.539 0.609 . . . . 72.03 110.009 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.461 ' CE2' HD11 ' A' ' 9' ' ' LEU . 41.5 t80 -49.39 -57.95 6.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.1 1.36 . . . . 51.2 112.643 -166.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.447 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 tp60 -64.28 -35.91 82.39 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 118.821 0.737 . . . . 63.01 112.03 -177.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -38.03 77.11 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.467 -0.568 . . . . 62.1 109.467 -178.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.69 -43.13 99.59 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.6 1.16 . . . . 63.2 109.73 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.461 HD11 ' CE2' ' A' ' 5' ' ' PHE . 59.5 mt -62.35 -16.33 53.76 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.596 -0.69 . . . . 35.15 112.583 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -104.6 -6.81 20.16 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.242 1.417 . . . . 63.14 112.171 176.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.02 13.6 2.66 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.447 1.899 . . . . 72.24 112.693 -168.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.84 4.36 58.98 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.307 1.432 . . . . 44.42 112.43 -171.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -102.81 158.0 32.62 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 118.727 1.264 . . . . 74.41 110.55 -162.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.01 -164.42 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.733 1 C-N-CA 126.304 4.67 . . . . 74.42 112.916 172.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.77 -54.98 4.19 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 120.379 -1.451 . . . . 74.1 109.599 161.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -50.42 -48.98 55.98 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.412 1.085 . . . . 74.51 113.818 -164.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.81 -46.9 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 125.175 1.39 . . . . 51.44 107.696 -173.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.14 -38.3 68.04 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.476 0.58 . . . . 62.22 111.313 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.73 -16.78 62.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.09 1.145 . . . . 75.54 114.09 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.5 2.25 16.24 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.873 1.215 . . . . 74.2 113.346 170.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -103.55 -34.23 8.74 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.7 1.2 . . . . 74.0 111.058 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.32 -40.71 74.84 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.272 0.487 . . . . 75.45 110.997 176.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.62 -44.7 9.12 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 128.908 2.883 . . . . 74.35 112.357 174.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -66.8 -19.8 26.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 74.32 110.23 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -100.37 -13.19 18.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.428 1.091 . . . . 75.25 112.637 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.5 t -89.06 -30.14 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.328 1.051 . . . . 75.34 111.165 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -85.01 10.76 11.02 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.115 -0.991 . . . . 75.33 112.973 -167.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.62 24.8 76.07 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.177 0.894 . . . . 74.11 113.815 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.0 mt -79.7 -83.75 0.1 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.229 2.212 . . . . 75.31 107.032 168.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.63 165.99 15.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 123.685 0.794 . . . . 54.51 112.931 -170.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.89 155.01 24.32 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.145 1.378 . . . . 64.02 109.436 164.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -76.1 -12.97 60.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.312 -0.851 . . . . 72.34 113.172 -175.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.1 m -124.91 36.15 4.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.169 1.788 . . . . 75.14 110.364 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -81.57 15.04 2.25 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 120.981 -1.075 . . . . 75.15 112.88 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -113.25 177.17 4.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.276 -1.515 . . . . 72.41 111.077 -163.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -112.81 160.4 18.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.46 1.104 . . . . 75.21 109.232 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.3 -45.23 72.52 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.277 1.031 . . . . 74.11 109.428 173.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtt85 -58.87 -25.96 63.81 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.939 0.896 . . . . 73.31 111.685 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.93 -45.09 29.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.894 0.77 . . . . 72.04 109.557 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.1 mm -58.47 -40.39 78.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.953 0.901 . . . . 55.23 109.394 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.73 -38.64 91.3 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.632 0.651 . . . . 72.03 110.188 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.14 -33.45 65.51 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.59 1.156 . . . . 51.22 111.536 -173.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.16 -46.09 79.42 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.179 0.899 . . . . 74.2 112.791 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -22.77 64.41 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.842 0.457 . . . . 64.4 111.824 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -75.62 -12.35 60.19 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 113.136 0.791 . . . . 72.04 113.136 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -88.81 164.52 15.18 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 119.614 1.097 . . . . 74.0 109.703 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -101.73 -175.84 2.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 125.347 1.459 . . . . 75.44 109.42 169.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -46.25 -58.58 3.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.527 1.531 . . . . 72.21 112.633 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.64 -46.15 83.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 108.186 -1.042 . . . . 73.22 108.186 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.83 -52.38 53.54 Favored Glycine 0 C--N 1.341 0.843 0 N-CA-C 111.3 -0.72 . . . . 62.23 111.3 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.97 91.83 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.557 0.743 . . . . 43.3 110.908 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.0 mt -61.74 -40.12 93.96 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.46 0.573 . . . . 75.34 111.186 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -65.3 -41.33 94.21 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.148 0.431 . . . . 74.1 111.419 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.44 -41.81 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.594 0.758 . . . . 63.13 109.681 175.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.77 -41.9 64.55 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.185 0.594 . . . . 71.13 110.452 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -54.9 -52.15 63.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.68 -0.859 . . . . 53.22 108.68 175.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -68.11 -34.13 75.81 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 119.239 -0.984 . . . . 62.43 110.26 -172.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -65.35 -53.84 37.74 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.856 0.462 . . . . 63.42 110.188 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.29 -41.8 76.5 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.003 0.819 . . . . 75.21 110.002 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.37 16.22 6.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.72 0.637 . . . . 72.44 112.72 -175.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.18 165.82 11.52 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.248 -1.532 . . . . 75.21 112.563 -179.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -88.61 93.21 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.587 -1.642 . . . . 63.55 110.333 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -87.83 53.62 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.838 1.255 . . . . 75.43 110.166 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 p -61.94 83.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.729 2.412 . . . . 75.43 112.279 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.3 m80 51.46 33.55 10.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.365 1.466 . . . . 72.32 112.38 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.449 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -52.16 111.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 127.111 2.164 . . . . 63.42 110.55 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -55.17 37.44 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.724 -0.61 . . . . 74.15 112.576 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -114.05 84.3 2.01 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.184 1.794 . . . . 72.15 109.292 -167.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HD3' HG13 ' A' ' 66' ' ' VAL . 41.6 mmtm -56.35 -26.83 53.97 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.676 1.191 . . . . 75.25 113.503 -172.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.05 -50.07 57.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 128.32 2.648 . . . . 54.52 109.262 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.8 -38.41 90.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.8 1.24 . . . . 72.04 110.405 -176.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.8 -47.86 83.22 Favored 'General case' 0 C--O 1.23 0.073 0 N-CA-C 109.153 -0.684 . . . . 73.42 109.153 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.3 tp -57.79 -52.59 64.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.336 -0.616 . . . . 63.45 109.336 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.76 -40.32 40.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.904 0.882 . . . . 73.24 111.197 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -44.64 94.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.826 0.727 . . . . 54.35 111.808 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.3 t -65.03 -43.03 96.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 122.087 -0.655 . . . . 63.34 109.799 176.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mtt -57.79 -40.25 79.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 120.799 -1.188 . . . . 62.42 111.323 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -51.82 -59.6 4.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.256 -0.878 . . . . 72.43 109.789 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -62.2 -34.49 76.56 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.898 0.772 . . . . 75.24 111.553 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.422 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 11.5 m-85 -68.06 -37.65 81.53 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 120.603 -1.311 . . . . 75.21 113.1 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -65.86 -45.9 80.42 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.867 0.758 . . . . 75.11 109.229 166.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 . . . . . 0 N--CA 1.446 -0.66 0 C-N-CA 124.484 1.114 . . . . 53.31 110.75 -161.868 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.462 ' HA2' ' OD1' ' A' ' 22' ' ' ASP . . . . . . . . 0 N--CA 1.467 0.753 0 N-CA-C 110.345 -1.102 . . . . 74.03 110.345 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 t -75.35 -170.21 1.16 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.125 0.97 . . . . 61.11 109.031 166.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -35.74 78.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.119 1.368 . . . . 53.24 111.823 167.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -58.87 -26.95 64.72 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.065 0.946 . . . . 63.22 112.811 -169.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -45.86 -41.37 11.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.492 1.917 . . . . 73.0 112.575 175.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -70.12 -37.42 75.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.869 -0.586 . . . . 71.32 111.847 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -39.5 92.73 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.977 0.808 . . . . 42.1 109.005 171.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 40.2 mt -59.57 -48.15 82.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.751 0.705 . . . . 63.05 111.66 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 23.5 mt -51.74 -38.96 57.56 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 123.95 0.9 . . . . 74.0 110.854 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -91.92 -6.96 50.46 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.092 0.557 . . . . 64.44 112.026 -174.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.86 2.17 50.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 120.411 -1.431 . . . . 75.33 110.928 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.79 -22.75 8.05 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 124.358 0.98 . . . . 32.12 112.013 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.15 144.82 67.88 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 117.675 0.737 . . . . 65.41 110.936 -159.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.47 156.23 61.71 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 C-N-CA 121.708 1.606 . . . . 74.02 109.361 164.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -59.4 -39.97 85.13 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 124.192 0.997 . . . . 70.01 108.83 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -56.11 -45.87 79.33 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 112.193 0.442 . . . . 74.13 112.193 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.69 -50.38 50.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 108.254 -1.017 . . . . 72.15 108.254 176.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.92 -42.71 65.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.466 0.706 . . . . 61.15 111.7 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -59.24 -55.6 32.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 119.127 0.876 . . . . 62.42 110.935 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.14 -30.51 69.67 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 118.593 -0.718 . . . . 71.11 111.166 -175.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.4 tp -76.39 -36.91 57.84 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.505 1.122 . . . . 72.04 110.609 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.462 ' OD1' ' HA2' ' A' ' 1' ' ' GLY . 1.1 t70 -55.5 -39.57 70.64 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.749 0.82 . . . . 64.25 110.755 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -29.63 69.41 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.783 1.633 . . . . 74.04 112.299 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 30' ' ' VAL . 2.4 mt -65.33 -33.07 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 107.662 -1.236 . . . . 72.35 107.662 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 11.0 m-85 -90.48 7.82 36.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.382 1.873 . . . . 75.24 112.951 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -99.15 -38.01 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 O-C-N 121.186 -0.947 . . . . 55.15 109.444 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.34 -17.45 59.4 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.25 0.833 . . . . 72.11 113.25 -165.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.4 13.18 52.58 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.413 0.551 . . . . 44.25 111.819 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.9 mt -78.06 -55.29 5.4 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.709 -0.848 . . . . 71.45 108.709 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.439 HG22 HG22 ' A' ' 24' ' ' ILE . 21.3 m -140.16 156.54 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.42 0.688 . . . . 74.33 109.873 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.17 158.66 26.25 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.236 -0.653 . . . . 74.12 109.236 164.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.439 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 19.2 p80 -62.26 -24.62 67.37 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.786 -0.571 . . . . 73.12 112.14 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.6 t -107.7 15.74 24.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.173 0.989 . . . . 75.01 111.793 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.38 -23.88 64.72 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.591 -1.318 . . . . 73.32 110.989 171.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.18 173.95 9.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.015 1.726 . . . . 73.11 110.599 -174.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.32 175.37 9.0 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.205 1.002 . . . . 73.35 108.87 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -44.83 -45.14 9.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.443 2.297 . . . . 73.11 114.589 -171.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -60.75 -21.85 63.43 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.958 0.799 . . . . 62.02 112.063 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -58.73 4.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.218 1.007 . . . . 40.11 109.993 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.479 ' H ' HD12 ' A' ' 40' ' ' ILE . 4.4 mp -56.31 -44.89 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.42 1.088 . . . . 62.15 110.924 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -55.45 -48.64 74.17 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.697 1.199 . . . . 73.32 110.987 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.42 86.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 118.408 -0.806 . . . . 72.33 111.101 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -52.95 -37.59 61.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.767 -0.635 . . . . 74.34 111.338 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -29.48 67.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.211 0.819 . . . . 72.05 113.211 174.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -66.99 -21.4 65.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 119.72 1.146 . . . . 71.24 111.366 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -88.27 143.58 26.94 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.323 1.049 . . . . 73.03 110.928 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -69.04 178.52 2.21 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.734 2.013 . . . . 64.02 111.292 163.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -51.14 -65.28 0.58 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.797 2.039 . . . . 43.52 110.939 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -37.67 76.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.723 0.809 . . . . 73.13 110.603 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.74 -37.05 66.84 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 111.431 -0.667 . . . . 33.33 111.431 -175.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.52 91.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.587 0.693 . . . . 71.12 109.496 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 mt -56.41 -37.86 70.76 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.949 -0.47 . . . . 72.14 111.038 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.53 81.47 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.291 0.496 . . . . 72.35 112.271 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 37.4 t -51.45 -38.31 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.801 0.728 . . . . 75.22 110.277 173.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.1 mt -73.2 -53.54 10.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.331 0.653 . . . . 61.31 109.923 -176.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.1 -43.18 73.79 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 124.001 0.813 . . . . 64.25 110.106 -176.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -69.11 -31.13 69.62 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 123.036 0.21 . . . . 63.43 110.957 -174.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -73.3 -49.46 27.38 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.148 0.979 . . . . 75.32 111.461 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -60.71 -38.76 86.15 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.876 1.216 . . . . 51.21 109.733 175.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.31 5.36 20.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.137 0.791 . . . . 74.33 113.137 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.6 p -74.44 170.65 15.24 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 119.929 1.24 . . . . 34.43 111.224 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -96.86 98.73 10.35 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.955 -1.128 . . . . 42.23 107.955 173.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.1 mt -98.99 25.39 6.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.482 1.113 . . . . 75.34 109.848 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 t -67.07 -38.86 86.51 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.26 -0.9 . . . . 64.44 111.16 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -130.97 23.65 4.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.046 0.938 . . . . 72.12 112.396 -170.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.45 165.57 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.393 1.077 . . . . 72.12 110.016 165.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -122.32 -85.68 0.65 Allowed 'General case' 0 C--O 1.234 0.256 0 N-CA-C 106.577 -1.638 . . . . 73.34 106.577 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.58 116.88 14.69 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.889 -1.152 . . . . 75.43 107.889 176.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB3' HG12 ' A' ' 30' ' ' VAL . 40.7 mmtm -64.15 -35.92 82.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.621 -0.674 . . . . 63.04 111.865 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.11 -52.51 65.22 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 126.193 1.797 . . . . 74.03 108.095 -176.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.54 -25.01 67.82 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.357 -0.838 . . . . 53.12 112.768 -175.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -74.85 -52.88 10.2 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.715 -0.846 . . . . 62.35 108.715 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.488 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.7 OUTLIER -61.28 -52.99 62.4 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.49 1.138 . . . . 75.04 109.109 -173.476 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.0 t -62.96 -20.75 65.55 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.407 -1.27 . . . . 72.34 110.741 -176.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.94 -53.44 5.79 Favored Glycine 0 C--N 1.34 0.787 0 CA-C-O 117.408 -1.773 . . . . 73.15 110.878 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 53.7 t -47.72 -50.58 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.148 1.474 . . . . 34.4 109.327 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.488 ' CE ' HD11 ' A' ' 73' ' ' LEU . 6.6 mtt -53.46 -50.98 64.15 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 119.6 -0.238 . . . . 62.33 111.007 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.548 ' HA ' HH11 ' A' ' 81' ' ' ARG . 3.5 ttmt -59.67 -47.44 85.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.612 -0.709 . . . . 74.45 110.621 -177.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.1 m -60.2 -38.58 83.73 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.134 -0.936 . . . . 53.43 111.064 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.89 -58.18 9.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.871 1.214 . . . . 71.22 111.1 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.548 HH11 ' HA ' ' A' ' 78' ' ' LYS . 6.2 ptp85 -57.88 -35.41 70.94 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 118.033 -0.984 . . . . 62.35 110.974 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 . . . . . 0 CA--C 1.548 0.885 0 C-N-CA 126.662 1.985 . . . . 71.35 114.381 -172.514 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.372 0 N-CA-C 109.74 -1.344 . . . . 50.21 109.74 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 t -127.36 -177.29 4.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.288 1.994 . . . . 70.14 111.196 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.48 -20.14 64.58 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 113.555 -1.657 . . . . 62.52 112.794 167.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -74.43 -27.64 60.7 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.591 1.087 . . . . 64.34 111.05 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -44.95 -53.46 7.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.324 1.45 . . . . 74.1 111.913 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -64.32 -37.8 88.79 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.97 0.508 . . . . 74.12 112.204 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 m -64.19 -48.78 74.61 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 108.895 -0.78 . . . . 53.13 108.895 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.0 mp -58.87 -42.71 90.1 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 124.094 0.958 . . . . 74.44 110.846 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.8 mt -56.59 -27.26 57.59 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.707 0.803 . . . . 74.43 111.034 177.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -101.05 -3.2 29.78 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.002 0.819 . . . . 54.31 112.764 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -89.5 10.31 23.29 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 120.522 -1.361 . . . . 74.52 112.679 -169.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.85 3.43 42.63 Favored Glycine 0 CA--C 1.527 0.804 0 C-N-CA 125.331 1.443 . . . . 70.21 113.072 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.3 mt -111.68 157.73 38.54 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 118.785 1.293 . . . . 70.22 111.201 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.43 167.89 18.77 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.169 2.579 . . . . 65.4 111.657 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -66.01 -47.42 74.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 124.615 1.166 . . . . 50.13 109.177 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -43.27 83.17 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.525 -0.47 . . . . 74.34 111.155 -172.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.77 -53.84 39.57 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.566 -1.272 . . . . 71.1 107.566 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.22 -51.34 45.05 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.334 1.054 . . . . 54.2 111.628 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -55.18 -45.37 75.79 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.805 0.73 . . . . 73.41 111.536 -178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -38.85 51.72 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 118.449 -0.786 . . . . 72.0 111.031 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.19 -39.24 71.93 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 126.451 1.9 . . . . 70.32 111.099 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.01 -42.26 79.99 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.981 1.313 . . . . 73.14 111.075 -177.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -64.93 -22.66 67.04 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.319 1.448 . . . . 74.12 113.03 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.443 HG23 ' HE3' ' A' ' 59' ' ' LYS . 9.4 mt -70.76 -22.25 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 O-C-N 121.068 -1.02 . . . . 73.23 108.571 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.77 23.55 11.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.683 1.993 . . . . 70.5 112.126 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 91.8 t -115.45 -38.92 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.269 1.028 . . . . 72.5 110.419 174.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.28 5.55 14.4 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.511 -0.743 . . . . 71.1 112.945 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 -8.84 76.93 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 127.329 2.395 . . . . 71.51 113.539 177.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.3 mt -61.96 -60.84 3.03 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 126.419 1.887 . . . . 72.13 110.084 -165.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 m -130.34 179.16 4.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.257 -0.883 . . . . 72.01 109.88 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -122.71 164.69 17.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.465 1.106 . . . . 73.22 109.13 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -59.7 -12.09 6.35 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.08 1.141 . . . . 74.43 114.08 -173.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.63 23.99 4.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.01 1.324 . . . . 65.14 112.564 -177.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -73.84 30.66 0.08 Allowed 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.591 -1.318 . . . . 74.31 111.382 169.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.6 mt -125.18 -177.48 3.88 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.079 2.152 . . . . 44.41 110.353 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -137.06 163.03 31.73 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.04 -1.467 . . . . 64.22 107.04 172.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -55.93 -37.99 69.68 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.647 1.579 . . . . 74.4 111.51 -175.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.0 ptt180 -55.53 -36.69 67.02 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.659 0.985 . . . . 45.53 113.659 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.07 -40.5 38.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.413 -0.588 . . . . 72.41 109.413 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.3 mm -60.78 -44.1 96.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 122.995 0.518 . . . . 72.0 110.268 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.46 -50.92 65.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.466 0.706 . . . . 65.31 109.819 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.24 71.15 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 117.644 -1.17 . . . . 45.14 112.68 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.85 -46.39 90.76 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.973 1.261 . . . . 51.14 110.066 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -40.94 98.88 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 118.022 0.374 . . . . 71.31 110.389 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -76.73 43.51 0.34 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.485 1.114 . . . . 62.4 111.999 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -138.41 149.59 45.66 Favored 'General case' 0 C--O 1.233 0.193 0 O-C-N 121.087 -1.008 . . . . 72.42 108.317 162.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -68.62 163.66 23.21 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.331 1.452 . . . . 73.12 110.358 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -47.83 -70.99 0.08 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 127.455 2.302 . . . . 63.43 110.864 -179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -70.52 -23.28 62.61 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.28 -0.263 . . . . 74.12 111.24 -172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.85 -60.74 5.83 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 109.938 -1.265 . . . . 70.43 109.938 176.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -47.63 -40.94 20.93 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.582 1.953 . . . . 53.32 111.884 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -46.86 83.29 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.668 1.187 . . . . 72.11 111.576 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.71 -45.84 81.6 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.036 0.446 . . . . 73.32 109.837 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.74 -37.89 62.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 123.283 0.633 . . . . 74.44 110.975 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.56 -45.37 75.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.192 -0.942 . . . . 73.4 109.938 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -56.04 -49.73 72.91 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.98 -0.748 . . . . 70.0 108.98 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -65.41 -28.2 69.08 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.14 0.427 . . . . 74.31 111.878 -174.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.86 -33.89 51.95 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.764 0.826 . . . . 62.41 112.943 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HE3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -63.04 -37.84 88.81 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.82 -1.175 . . . . 72.0 110.005 168.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -83.76 52.63 2.32 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.903 2.481 . . . . 74.41 109.995 -175.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.62 170.97 17.88 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.42 1.088 . . . . 71.3 110.457 170.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.46 77.4 1.09 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 125.746 1.619 . . . . 73.21 108.017 -169.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.17 49.53 0.69 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.161 1.384 . . . . 74.41 110.977 -175.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -111.12 -21.51 11.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.201 1.8 . . . . 72.22 112.205 -175.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -130.64 16.58 5.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.239 1.016 . . . . 71.34 111.776 176.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.5 t -90.52 104.85 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 107.586 -1.264 . . . . 63.41 107.586 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -58.43 -35.42 72.07 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.709 0.633 . . . . 65.23 112.709 175.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.5 p30 -129.07 78.74 1.87 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.988 0.899 . . . . 42.3 111.472 -170.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 44.0 mmtt -48.26 -40.68 25.46 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.516 1.526 . . . . 72.41 110.445 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.6 p -55.22 -61.01 2.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.443 2.697 . . . . 72.23 111.364 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.7 -29.81 70.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 119.111 -0.471 . . . . 72.1 111.278 -177.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -63.07 -52.23 63.57 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.466 -0.939 . . . . 72.12 108.466 173.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.84 -47.06 81.2 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.047 1.339 . . . . 74.13 109.836 178.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -27.13 68.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.012 0.925 . . . . 72.42 111.907 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.76 -54.84 6.96 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 109.603 -1.399 . . . . 71.14 109.603 176.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 89.0 t -52.36 -48.14 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.867 0.867 . . . . 74.14 109.562 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 36.2 mtt -50.25 -52.27 37.57 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.908 -1.12 . . . . 63.02 111.237 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.28 89.34 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 118.01 -0.995 . . . . 61.21 111.184 -171.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 t -67.74 -28.29 67.51 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.954 1.252 . . . . 74.32 111.178 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -71.32 -46.27 61.06 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.57 1.532 . . . . 74.31 110.612 169.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.78 24.71 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.419 -1.426 . . . . 73.13 113.068 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.537 0.466 0 C-N-CA 127.015 2.126 . . . . 73.31 111.753 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.53 0 N-CA-C 110.574 -1.01 . . . . 64.23 110.574 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -69.18 179.73 1.84 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.382 0.61 . . . . 64.12 109.536 157.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -49.48 -35.9 21.21 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.356 1.463 . . . . 64.45 113.002 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.73 -34.6 74.65 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.184 0.993 . . . . 75.45 109.771 -166.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -44.77 -54.57 6.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.004 1.322 . . . . 61.12 110.486 176.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -66.56 -31.62 72.45 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.974 -1.013 . . . . 63.45 111.848 -176.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -60.08 -46.73 88.62 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.74 1.155 . . . . 75.25 109.63 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.45 -40.48 95.81 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.206 -0.934 . . . . 62.25 110.963 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.41 -20.09 65.25 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.796 0.725 . . . . 72.52 112.139 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -86.87 -36.78 18.24 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.366 1.066 . . . . 71.24 109.081 175.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.06 64.28 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.599 1.96 . . . . 72.34 113.38 -166.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.87 17.0 2.61 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 119.322 -0.71 . . . . 55.13 113.176 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.3 mt -112.8 148.08 38.55 Favored Pre-proline 0 C--O 1.239 0.509 0 CA-C-N 118.133 0.966 . . . . 60.13 111.96 -156.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.07 154.19 70.89 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.793 2.328 . . . . 74.41 109.112 174.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.0 -40.88 78.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 108.024 -1.102 . . . . 62.55 108.024 -168.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -56.53 18.31 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 123.741 0.65 . . . . 52.05 109.862 -175.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.7 t -58.36 -45.37 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 N-CA-C 108.166 -1.05 . . . . 74.54 108.166 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.24 80.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.367 0.877 . . . . 73.21 113.367 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -55.5 -35.74 65.91 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.6 0.76 . . . . 64.34 111.1 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -91.84 -15.89 27.54 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.232 1.413 . . . . 74.44 111.544 -173.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.581 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -79.45 -38.54 34.4 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 124.787 1.235 . . . . 63.53 111.799 171.631 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -52.68 -48.2 66.68 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 123.949 0.9 . . . . 61.43 109.628 -171.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -64.91 -5.25 5.67 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.082 2.153 . . . . 75.11 115.092 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.1 mt -90.82 -10.72 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 124.386 1.074 . . . . 75.41 109.544 173.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.581 ' HE2' HD23 ' A' ' 21' ' ' LEU . 67.5 m-85 -109.93 6.29 23.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.218 1.407 . . . . 74.14 113.95 -178.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -120.14 -5.82 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.779 1.232 . . . . 73.33 111.819 -173.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.68 6.22 23.54 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.269 -1.519 . . . . 74.11 112.311 -172.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.19 12.54 84.05 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.181 0.895 . . . . 31.23 113.614 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.69 -65.19 0.89 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.608 1.963 . . . . 73.15 109.628 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -129.84 156.98 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 N-CA-C 113.765 1.024 . . . . 75.44 113.765 171.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.97 149.86 39.21 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 125.605 1.562 . . . . 70.55 109.945 161.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -55.92 -47.96 76.57 Favored 'General case' 0 C--O 1.228 -0.062 0 C-N-CA 123.634 0.773 . . . . 61.11 110.962 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.1 t -83.77 3.2 34.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.346 0.498 . . . . 70.44 112.346 -172.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -67.48 -28.49 67.9 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.763 -1.211 . . . . 72.15 111.911 -174.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.67 155.24 40.82 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.311 -0.625 . . . . 74.52 109.311 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -111.61 167.02 10.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.388 -0.968 . . . . 74.1 108.388 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.16 -37.42 64.43 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.041 0.536 . . . . 72.34 112.313 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -54.84 -39.52 68.66 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.24 0.473 . . . . 73.0 111.828 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.02 -39.28 66.12 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.955 -0.545 . . . . 61.43 110.955 177.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.66 -46.05 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.972 0.805 . . . . 63.43 108.99 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.39 -55.73 30.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.854 1.662 . . . . 71.03 110.298 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.65 76.52 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.852 0.461 . . . . 61.21 111.176 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.49 -52.49 65.18 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.226 1.011 . . . . 73.24 110.642 173.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.53 -18.95 3.19 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 117.575 -1.202 . . . . 63.32 113.6 171.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -86.37 -7.13 58.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 121.896 2.134 . . . . 60.21 114.877 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -90.15 -177.34 5.12 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.547 1.521 . . . . 74.11 110.948 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -105.67 173.52 6.28 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 124.971 1.308 . . . . 62.42 108.962 162.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -53.85 -69.87 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 126.065 1.746 . . . . 75.42 111.144 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -68.47 -10.81 57.91 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.86 1.664 . . . . 75.3 111.581 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -74.24 -72.98 0.96 Allowed Glycine 0 C--N 1.339 0.719 0 N-CA-C 108.504 -1.838 . . . . 62.22 108.504 172.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.83 -36.95 49.95 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.142 0.977 . . . . 74.23 112.343 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.73 -44.97 94.82 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.909 0.884 . . . . 64.3 111.137 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.65 92.04 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.822 0.737 . . . . 63.02 111.698 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLY . 57.3 t -56.62 -30.97 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.978 1.311 . . . . 74.21 110.503 -178.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.6 mt -68.19 -45.91 72.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.426 1.49 . . . . 75.51 110.791 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -54.37 -42.62 70.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.247 -0.649 . . . . 75.31 109.247 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -76.91 0.88 19.31 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.738 1.014 . . . . 63.12 113.738 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -110.39 -41.16 4.44 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.786 1.635 . . . . 73.3 111.402 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -28.47 68.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 120.432 -1.417 . . . . 72.2 111.029 175.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -82.59 1.75 36.57 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 118.625 -0.702 . . . . 53.31 112.716 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.5 m -92.45 -176.11 4.21 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 120.341 1.428 . . . . 71.24 111.105 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.99 79.88 1.93 Allowed 'General case' 0 C--O 1.24 0.566 0 C-N-CA 126.024 1.73 . . . . 62.4 109.246 -170.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.45 HD22 ' H ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -86.1 -6.43 59.02 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.038 -1.664 . . . . 72.44 113.309 -162.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.1 -62.3 1.54 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.585 1.954 . . . . 62.54 111.651 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -86.31 2.04 48.8 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.551 0.74 . . . . 72.14 112.462 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.95 151.58 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.259 -0.901 . . . . 71.13 109.504 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -83.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.414 1.886 . . . . 61.13 108.868 174.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -98.33 117.74 33.41 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 74.44 107.569 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.3 mmtm -56.6 -39.25 73.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.03 0.832 . . . . 70.31 110.859 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -47.38 74.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.631 1.172 . . . . 74.3 110.446 -174.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.29 -23.67 67.09 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.431 -0.507 . . . . 51.42 111.71 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -64.34 -55.49 20.81 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 107.873 -1.158 . . . . 65.4 107.873 173.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.98 -50.68 63.65 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.24 1.816 . . . . 64.31 110.559 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.61 -22.01 66.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.113 -0.494 . . . . 74.4 111.835 -177.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.43 -52.09 42.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.214 -1.154 . . . . 51.51 110.214 172.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.4 t -55.3 -46.4 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 123.735 0.814 . . . . 74.01 109.033 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 46.4 mtt -55.37 -41.62 72.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.077 0.769 . . . . 73.42 113.077 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.29 -46.83 85.37 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.932 0.787 . . . . 60.13 109.238 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -57.8 -56.14 25.84 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.065 0.546 . . . . 71.0 109.944 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CG ' HG22 ' A' ' 54' ' ' VAL . 22.8 m-85 -55.39 -43.58 75.32 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.976 0.807 . . . . 62.04 111.527 -178.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -3.22 37.17 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.93 -1.106 . . . . 71.42 113.847 -177.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.242 0 C-N-CA 126.0 1.72 . . . . 72.12 107.714 171.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.481 ' HA3' ' OD2' ' A' ' 22' ' ' ASP . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 109.691 -1.364 . . . . 73.24 109.691 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -137.97 -168.55 2.37 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.04 0.536 . . . . 73.12 110.012 -163.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -57.21 -29.27 63.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.057 0.943 . . . . 74.23 112.616 -177.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -66.86 -37.4 84.37 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 123.424 0.69 . . . . 72.05 109.3 -165.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -46.35 -59.86 2.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.577 0.751 . . . . 63.25 111.132 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -60.91 -45.93 92.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.976 -0.535 . . . . 73.25 112.228 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -68.34 -26.58 65.68 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.385 0.993 . . . . 70.04 110.824 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -35.22 77.3 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 119.857 -1.777 . . . . 73.14 110.339 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.28 -20.39 66.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.529 1.059 . . . . 51.44 111.536 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.06 -17.83 21.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.408 0.683 . . . . 61.22 112.361 175.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.61 9.51 1.39 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.227 1.411 . . . . 71.03 112.448 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.11 17.6 71.6 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.566 1.079 . . . . 33.2 113.096 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -103.76 156.32 35.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.403 1.081 . . . . 72.32 110.684 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.16 160.03 46.19 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.051 3.167 . . . . 74.23 113.062 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -63.88 -45.7 88.19 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.717 0.807 . . . . 74.34 109.248 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -23.67 65.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.901 -1.12 . . . . 52.12 112.353 -168.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -70.66 -56.94 9.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 N-CA-C 106.726 -1.583 . . . . 62.24 106.726 168.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.01 -40.21 60.64 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.385 0.993 . . . . 71.04 113.058 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.52 -15.19 57.21 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.52 1.528 . . . . 71.21 113.667 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.3 -18.87 12.4 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.651 1.581 . . . . 73.23 112.108 173.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.2 tp -92.42 -29.65 16.17 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 126.15 1.78 . . . . 74.33 111.581 -173.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.481 ' OD2' ' HA3' ' A' ' 1' ' ' GLY . 5.9 t0 -56.97 -43.88 82.09 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 123.495 0.718 . . . . 73.41 110.416 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -34.25 66.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.902 2.081 . . . . 74.25 113.811 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.482 HD12 ' HE2' ' A' ' 59' ' ' LYS . 11.5 mm -58.85 -20.69 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 123.932 0.893 . . . . 74.33 109.289 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 32' ' ' HIS . 39.5 m-85 -104.67 9.53 35.12 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.676 1.59 . . . . 74.12 112.968 177.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -116.21 -32.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.593 1.557 . . . . 75.21 111.068 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.68 24.22 0.89 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.847 0.859 . . . . 74.35 111.19 -176.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.01 80.62 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.98 1.753 . . . . 74.03 113.93 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.697 HD13 ' HE3' ' A' ' 59' ' ' LYS . 2.2 mt -73.78 -63.89 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.873 1.337 . . . . 64.03 110.527 -168.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.55 158.71 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.392 1.077 . . . . 54.42 113.465 -169.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.15 13.04 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 127.732 2.413 . . . . 54.15 115.47 -172.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 25' ' ' TYR 0.258 6.7 p-80 56.11 -21.77 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.939 2.496 . . . . 71.04 116.604 -161.452 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 23.9 5.55 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.59 1.556 . . . . 74.01 111.409 -177.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -70.15 19.13 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.617 1.967 . . . . 64.23 113.766 -175.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.8 mt -129.22 -171.83 2.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.439 1.496 . . . . 72.42 110.701 -152.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.91 169.74 17.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 126.969 2.107 . . . . 74.0 107.806 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -47.28 -46.03 24.47 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 126.537 1.935 . . . . 73.5 112.423 -169.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -54.97 -29.32 56.62 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.746 0.647 . . . . 74.2 112.746 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.63 -47.81 65.67 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 118.828 -0.606 . . . . 74.04 110.605 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.523 ' H ' HD12 ' A' ' 40' ' ' ILE . 3.6 mp -71.19 -43.46 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 119.024 0.829 . . . . 71.41 109.707 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -67.87 -48.09 67.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 119.129 -0.462 . . . . 62.12 110.456 -173.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -22.5 64.11 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.014 0.825 . . . . 73.34 111.985 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.05 -37.5 77.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.575 1.08 . . . . 71.23 111.847 166.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm -65.82 -25.63 67.31 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.803 0.729 . . . . 70.54 111.544 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -87.77 21.75 2.52 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.422 -0.799 . . . . 70.21 111.976 -167.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -125.37 156.93 37.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.924 -1.11 . . . . 54.13 109.95 175.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -67.94 169.71 9.46 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.702 -0.681 . . . . 65.42 109.534 155.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -50.27 -58.86 4.7 Favored 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 125.727 1.611 . . . . 73.51 109.603 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -4.04 35.03 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.317 1.047 . . . . 50.34 112.26 -174.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -86.12 -57.09 2.18 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 109.055 -1.618 . . . . 61.21 109.055 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.99 89.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.94 1.296 . . . . 73.32 112.233 -175.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.74 -44.29 93.85 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 119.18 0.9 . . . . 73.34 110.572 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.65 -43.89 93.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 120.571 -0.451 . . . . 54.43 111.226 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 61.1 t -54.34 -41.11 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.285 -0.884 . . . . 62.5 110.264 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.54 -52.22 58.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.4 -0.593 . . . . 74.3 109.4 -178.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -58.18 -33.67 69.5 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 123.759 0.662 . . . . 75.12 109.609 -174.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -91.87 -27.77 17.73 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.69 0.677 . . . . 72.53 111.745 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -62.08 -20.96 64.56 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.469 0.652 . . . . 73.2 110.971 164.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.697 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -102.57 -19.47 14.84 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 113.594 0.961 . . . . 64.3 113.594 176.322 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -80.5 59.99 3.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.059 1.744 . . . . 60.51 107.003 158.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.1 m -158.1 163.72 37.35 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.526 1.531 . . . . 71.1 107.708 170.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -105.92 128.91 54.09 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 105.137 -2.171 . . . . 74.51 105.137 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.0 mt -116.35 44.83 1.9 Allowed 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.701 2.4 . . . . 75.22 109.004 -172.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.3 m -59.08 95.58 0.03 OUTLIER 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.726 0.81 . . . . 71.41 111.395 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 49.14 35.05 6.56 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 128.309 2.643 . . . . 75.44 113.485 177.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.445 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -60.02 111.53 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.682 -1.229 . . . . 74.11 107.682 169.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -67.23 -40.12 86.31 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.705 -1.247 . . . . 63.34 109.762 168.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -78.32 50.45 0.93 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.201 1.4 . . . . 60.11 112.514 -170.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD3' HG13 ' A' ' 66' ' ' VAL . 35.1 mmtm -52.71 -39.93 62.49 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 120.946 -1.096 . . . . 72.41 112.196 -177.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.7 p -66.13 -53.35 38.91 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.325 1.05 . . . . 72.53 110.14 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -38.45 84.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.1 -0.476 . . . . 74.13 110.723 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -62.58 -49.55 74.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 108.93 -0.767 . . . . 75.21 108.93 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.68 -50.61 70.46 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.89 0.876 . . . . 73.24 109.795 -177.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.5 t -64.93 -21.82 66.89 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.106 0.962 . . . . 33.14 110.943 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.37 -53.46 13.29 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 126.063 1.792 . . . . 71.51 110.795 169.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -55.81 -47.93 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.736 1.268 . . . . 73.23 108.652 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 44.7 mtt -48.05 -56.9 6.63 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.95 0.9 . . . . 72.22 110.839 172.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -59.13 -43.53 92.0 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.882 -0.784 . . . . 73.23 108.882 -175.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -60.99 -35.34 76.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 119.244 -0.408 . . . . 70.32 111.647 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -65.83 -42.53 90.41 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.558 -1.339 . . . . 72.2 112.71 175.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -79.35 -15.91 57.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 118.407 -0.806 . . . . 72.14 113.108 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 . . . . . 0 N--CA 1.45 -0.451 0 C-N-CA 126.535 1.934 . . . . 71.11 107.327 -174.073 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.445 0 N-CA-C 110.19 -1.164 . . . . 42.25 110.19 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -119.48 -173.41 2.52 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 124.743 1.217 . . . . 41.11 111.684 -169.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -44.18 -45.04 8.17 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.162 2.185 . . . . 73.14 110.899 179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -65.73 -34.44 78.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 124.632 1.173 . . . . 75.31 110.649 -170.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 46.4 t80 -54.62 -50.04 69.05 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.17 0.988 . . . . 63.45 112.133 -170.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 tp60 -65.97 -40.59 91.4 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-O 119.082 -0.485 . . . . 73.52 111.253 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 62.3 m -61.65 -45.51 93.74 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 122.788 0.435 . . . . 72.42 110.294 175.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 52.3 mt -61.4 -43.15 99.36 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 123.493 0.717 . . . . 44.31 111.993 -176.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.4 mt -57.77 -40.33 79.53 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 109.587 -0.523 . . . . 63.32 109.587 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -82.09 -20.27 38.5 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 120.646 0.26 . . . . 72.11 111.26 -172.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -74.41 18.91 0.14 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 128.643 2.777 . . . . 75.21 111.895 169.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.413 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 89.18 -0.43 81.52 Favored Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 125.157 1.36 . . . . 34.1 114.115 168.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 90.8 mt -77.08 147.93 77.59 Favored Pre-proline 0 C--O 1.236 0.393 0 CA-C-N 118.863 1.332 . . . . 62.21 111.107 -172.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.32 156.93 60.54 Favored 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 122.152 1.901 . . . . 64.34 109.441 165.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.47 -42.93 97.24 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 124.127 0.971 . . . . 71.11 108.909 -176.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -58.1 -37.15 74.0 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-O 118.608 -0.71 . . . . 72.21 111.602 -174.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 78.1 t -78.58 -47.27 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.446 1.098 . . . . 73.13 108.287 -179.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.32 -40.16 70.82 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.173 0.589 . . . . 61.21 111.578 -178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.41 -55.35 22.33 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.881 1.273 . . . . 71.21 110.98 178.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -65.69 -45.25 83.53 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.022 0.529 . . . . 71.44 110.101 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.6 tp -67.09 -36.08 81.2 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.095 0.558 . . . . 71.55 111.685 -167.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -54.61 -45.59 73.68 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 124.486 1.115 . . . . 74.13 110.521 178.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -63.84 -19.75 65.28 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 114.26 1.208 . . . . 53.42 114.26 -178.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.413 HG22 HG22 ' A' ' 30' ' ' VAL . 14.3 mt -72.11 -27.91 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 N-CA-C 108.746 -0.835 . . . . 71.32 108.746 177.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.65 -23.12 24.34 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.649 1.18 . . . . 75.13 111.656 178.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.9 t -73.14 -33.56 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 123.624 0.77 . . . . 71.43 111.262 177.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -96.44 17.59 15.77 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 113.509 0.929 . . . . 71.53 113.509 -164.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 68.21 33.41 78.17 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 123.781 0.705 . . . . 75.45 114.343 170.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.5 mt -94.48 -75.03 0.52 Allowed 'General case' 0 C--N 1.331 -0.222 0 C-N-CA 127.295 2.238 . . . . 74.24 108.883 176.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.413 HG22 HG22 ' A' ' 24' ' ' ILE . 17.6 m -123.32 163.66 22.08 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 124.64 1.176 . . . . 74.53 110.057 -174.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -79.86 160.73 25.96 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 122.901 0.481 . . . . 74.14 110.492 167.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -75.67 -28.08 58.56 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.566 -0.709 . . . . 61.41 110.169 166.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.2 p -81.69 -1.05 45.51 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.098 0.959 . . . . 74.34 112.272 177.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -72.47 -13.24 61.39 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 121.354 -0.841 . . . . 75.32 112.95 -171.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -84.35 156.99 21.61 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 124.624 1.169 . . . . 55.35 111.246 -174.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -91.35 163.21 14.29 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 124.398 1.079 . . . . 42.31 108.186 164.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -61.87 -28.35 69.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 122.764 0.426 . . . . 51.35 110.589 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.0 mtp180 -62.63 -29.92 70.98 Favored 'General case' 0 N--CA 1.466 0.363 0 O-C-N 120.795 -1.191 . . . . 74.11 111.059 178.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.87 -47.09 49.07 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 118.644 -0.693 . . . . 33.32 109.824 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 29.0 mm -57.22 -38.69 62.88 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 CA-C-N 118.587 0.63 . . . . 55.31 110.224 -179.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -73.44 -54.44 8.26 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.101 0.56 . . . . 61.13 110.573 179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.99 -21.2 64.65 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 112.26 0.467 . . . . 72.54 112.26 -176.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 6.1 mt -63.11 -42.9 99.66 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 124.757 1.223 . . . . 74.43 111.714 171.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.0 OUTLIER -70.52 -24.34 62.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 119.767 1.167 . . . . 63.15 110.957 173.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -76.84 34.6 0.15 Allowed 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.155 -0.966 . . . . 62.43 111.503 172.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -134.49 151.93 51.46 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 124.286 1.034 . . . . 71.13 108.403 165.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -78.86 176.73 9.31 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.191 0.52 . . . . 64.53 109.784 161.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -61.3 2.51 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 125.863 1.665 . . . . 73.25 111.32 -176.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -67.07 -24.48 65.97 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 123.081 0.552 . . . . 55.03 111.431 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.52 -69.64 1.22 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 109.331 -1.508 . . . . 52.43 109.331 170.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.43 -41.27 76.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 125.26 1.424 . . . . 52.02 111.503 -177.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 42.9 mt -62.03 -39.4 92.19 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 118.37 -0.824 . . . . 71.51 111.501 179.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.6 -47.29 84.42 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.572 0.624 . . . . 75.22 110.012 173.228 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 14.7 t -55.4 -40.68 58.76 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 118.371 0.532 . . . . 73.52 110.569 178.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.8 mt -69.26 -45.72 69.03 Favored 'General case' 0 CA--C 1.518 -0.27 0 C-N-CA 123.623 0.769 . . . . 64.11 109.794 -176.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -58.49 -51.73 68.64 Favored 'General case' 0 N--CA 1.449 -0.523 0 O-C-N 123.885 0.741 . . . . 73.23 109.462 175.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -69.57 -30.68 68.52 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.531 0.605 . . . . 60.11 111.407 -171.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -67.13 -39.82 86.68 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.865 1.266 . . . . 74.33 111.266 173.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.0 -43.71 78.25 Favored 'General case' 0 CA--C 1.529 0.146 0 O-C-N 121.493 -0.754 . . . . 60.43 110.083 171.506 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -76.96 46.49 0.48 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 126.497 1.919 . . . . 63.33 110.212 175.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.96 -174.77 3.47 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 126.923 2.089 . . . . 61.34 107.686 170.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -120.02 112.27 18.94 Favored 'General case' 0 N--CA 1.447 -0.618 0 C-N-CA 124.628 1.171 . . . . 54.34 108.565 176.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 69.0 mt -95.59 30.2 2.37 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.297 1.439 . . . . 71.42 110.295 178.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.95 -69.89 0.34 Allowed 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 107.933 -1.136 . . . . 65.44 107.933 163.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -80.19 39.22 0.44 Allowed 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.27 1.428 . . . . 73.42 113.083 -173.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 14.7 p -106.91 165.17 4.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.128 0.971 . . . . 53.52 108.83 170.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -142.68 -70.52 0.33 Allowed 'General case' 0 C--O 1.233 0.201 0 C-N-CA 124.99 1.316 . . . . 72.15 108.9 170.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 24.8 p30 -56.99 75.8 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 128.993 2.917 . . . . 75.44 111.204 159.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 31.7 mmtm -51.24 -32.04 22.89 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.262 -0.899 . . . . 74.12 111.644 175.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 33.8 p -65.47 -56.84 10.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 118.587 0.63 . . . . 64.55 109.977 178.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.67 -33.97 68.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.257 0.623 . . . . 73.11 111.436 -175.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -60.82 -53.08 61.67 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-O 121.299 0.571 . . . . 72.23 109.945 176.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.1 tp -62.46 -42.45 99.47 Favored 'General case' 0 N--CA 1.461 0.078 0 CA-C-O 121.445 0.641 . . . . 65.22 110.025 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -55.42 -37.75 68.08 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.79 1.636 . . . . 72.51 110.379 176.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.66 -57.4 17.91 Favored Glycine 0 CA--C 1.523 0.534 0 C-N-CA 124.966 1.27 . . . . 74.42 110.462 174.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -55.44 -47.86 77.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-N 117.804 0.802 . . . . 40.03 109.366 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 12.4 mtt -52.78 -46.74 67.74 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.985 0.914 . . . . 72.24 112.165 176.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.9 mttt -57.8 -49.92 75.0 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 118.796 0.725 . . . . 61.32 109.52 179.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -43.42 54.7 Favored 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.465 0.706 . . . . 62.12 111.647 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -71.8 -38.12 70.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 114.166 1.172 . . . . 72.31 114.166 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -73.66 -21.87 60.14 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 119.97 1.259 . . . . 74.44 111.786 172.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -101.03 69.37 1.3 Allowed 'General case' 0 N--CA 1.45 -0.442 0 C-N-CA 124.399 1.08 . . . . 61.34 108.609 -177.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 -128.33 68.69 1.36 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 124.496 1.119 . . . . 63.11 108.461 -178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -124.16 123.58 40.61 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 106.725 -1.583 . . . . 74.42 106.725 177.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.2 tptp . . . . . 0 C--O 1.25 1.118 0 N-CA-C 108.761 -0.829 . . . . 75.15 108.761 -170.878 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.554 0 N-CA-C 109.801 -1.32 . . . . 72.54 109.801 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 t -129.34 -175.05 3.45 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.518 1.127 . . . . 70.1 110.453 -176.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -65.19 -17.6 64.62 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 126.649 1.98 . . . . 74.31 113.924 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -67.95 -36.94 80.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.136 0.88 . . . . 65.2 109.09 179.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.53 ' CE2' HD11 ' A' ' 9' ' ' LEU . 54.8 t80 -46.51 -53.35 11.46 Favored 'General case' 0 CA--C 1.528 0.113 0 C-N-CA 125.897 1.679 . . . . 62.24 112.577 -177.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.45 -47.26 86.15 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.769 0.428 . . . . 45.2 111.552 -175.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.7 m -67.93 -35.59 78.69 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 110.042 -0.355 . . . . 74.12 110.042 -176.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.1 mp -75.7 -34.96 60.43 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.38 -0.825 . . . . 73.34 112.067 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.53 HD11 ' CE2' ' A' ' 5' ' ' PHE . 17.3 mt -54.54 -36.23 64.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 123.32 0.648 . . . . 72.43 110.063 166.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -83.46 -21.07 32.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 123.669 0.788 . . . . 74.43 111.705 -174.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -71.6 1.51 6.53 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.519 1.928 . . . . 71.43 112.236 174.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.47 0.79 46.9 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 124.683 1.135 . . . . 51.14 113.28 174.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 75.7 mt -84.94 144.72 42.19 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 118.241 1.02 . . . . 73.2 109.636 -169.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -62.91 156.04 56.62 Favored 'Trans proline' 0 N--CA 1.455 -0.764 0 C-N-CA 121.922 1.748 . . . . 52.0 110.285 173.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -59.32 -45.7 90.59 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 124.951 1.3 . . . . 62.11 108.698 179.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -60.17 -39.59 86.95 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 123.366 0.416 . . . . 74.33 111.098 -172.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 42.8 t -64.72 -58.78 5.74 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.196 0 C-N-CA 125.681 1.592 . . . . 63.33 107.994 172.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.47 -44.99 46.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.448 1.099 . . . . 61.42 112.532 -174.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -58.6 -41.76 86.58 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 119.458 1.026 . . . . 44.41 111.467 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -73.61 -39.55 64.49 Favored 'General case' 0 N--CA 1.467 0.387 0 O-C-N 121.809 -0.557 . . . . 74.33 110.739 177.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.9 tp -69.76 -39.64 76.57 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.852 1.261 . . . . 73.32 110.811 -169.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -53.85 -47.1 71.32 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 124.952 1.301 . . . . 74.11 110.819 177.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -57.76 -24.78 58.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.77 1.628 . . . . 65.55 113.468 178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.7 mt -75.07 -25.09 18.12 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 O-C-N 121.128 -0.983 . . . . 72.25 109.183 -179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -89.43 -10.4 46.58 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.885 1.674 . . . . 70.32 112.706 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 46.8 t -84.79 -32.84 7.82 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 C-N-CA 124.406 1.082 . . . . 65.32 111.975 -177.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -91.73 13.86 16.97 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.91 0.777 . . . . 73.34 112.985 -168.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 61.55 31.44 77.68 Favored Glycine 0 CA--C 1.53 1.004 0 O-C-N 121.617 -0.677 . . . . 54.14 112.4 -179.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.451 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 22.1 mt -83.54 -65.02 1.06 Allowed 'General case' 0 CA--C 1.517 -0.302 0 C-N-CA 126.799 2.04 . . . . 71.13 108.282 175.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 18.8 m -128.69 156.83 41.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 C-N-CA 123.157 0.583 . . . . 71.02 109.894 -177.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.48 154.65 21.65 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.267 0.627 . . . . 50.25 110.192 172.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.2 p80 -62.42 -15.1 47.33 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-O 118.729 -0.653 . . . . 73.25 112.547 175.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 30.8 p -120.22 22.25 11.45 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.217 1.807 . . . . 74.11 112.319 179.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -84.94 -3.49 58.76 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-O 123.265 1.507 . . . . 73.24 112.713 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -94.53 -172.86 2.87 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 126.334 1.854 . . . . 71.32 109.47 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.2 p30 -127.21 175.59 8.04 Favored 'General case' 0 C--N 1.327 -0.382 0 C-N-CA 123.366 0.666 . . . . 74.42 111.584 170.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -63.69 -32.69 74.26 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.563 0.745 . . . . 75.23 111.282 -179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.1 mtp180 -61.83 -37.29 83.89 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.497 0.719 . . . . 74.35 109.947 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -63.0 -39.17 93.94 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 123.651 0.78 . . . . 63.11 110.867 175.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 21.2 mm -63.62 -50.92 76.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 118.954 0.797 . . . . 62.14 109.965 -179.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -62.11 -51.25 68.67 Favored 'General case' 0 C--O 1.23 0.059 0 N-CA-C 109.875 -0.417 . . . . 71.22 109.875 -179.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.3 -27.47 69.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-O 118.164 -0.922 . . . . 74.41 112.299 -176.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.0 mt -61.07 -51.73 67.91 Favored 'General case' 0 C--N 1.341 0.229 0 CA-C-N 118.955 0.798 . . . . 74.55 110.661 169.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.11 -39.99 83.97 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 119.003 0.82 . . . . 72.41 111.487 176.692 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -77.12 38.45 0.22 Allowed 'General case' 0 C--O 1.24 0.583 0 CA-C-N 119.285 0.948 . . . . 74.54 112.473 179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -129.1 146.75 50.97 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.335 -1.357 . . . . 72.33 107.335 161.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 19.2 p-10 -68.49 170.3 9.31 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-O 120.826 0.346 . . . . 74.14 110.483 163.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -47.53 -64.17 0.86 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 127.38 2.272 . . . . 64.55 110.786 176.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -65.98 -31.12 71.84 Favored 'General case' 0 C--O 1.231 0.118 0 C-N-CA 123.365 0.666 . . . . 73.43 110.871 -172.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.84 -53.95 10.56 Favored Glycine 0 C--N 1.336 0.573 0 N-CA-C 110.319 -1.112 . . . . 62.24 110.319 178.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.5 -37.63 75.98 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.8 1.24 . . . . 70.24 111.599 177.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -59.98 -43.32 95.21 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 119.447 1.021 . . . . 65.53 110.937 175.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.512 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -61.74 -45.07 95.53 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 121.992 0.901 . . . . 61.14 110.785 178.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.23 -37.5 56.66 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.939 0.896 . . . . 50.42 110.315 176.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.03 -48.6 20.32 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 119.057 0.844 . . . . 70.14 110.994 -178.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -57.5 -41.74 81.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.592 -0.892 . . . . 72.34 108.592 -176.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -82.65 -10.07 59.1 Favored 'General case' 0 C--N 1.34 0.174 0 N-CA-C 112.866 0.691 . . . . 74.35 112.866 -176.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -67.18 -61.03 2.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 108.805 -0.813 . . . . 74.52 108.805 166.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.451 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 0.9 OUTLIER -65.74 -39.73 91.39 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-O 118.697 -0.668 . . . . 70.44 110.453 -178.9 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.6 t0 -82.73 54.63 2.74 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.289 1.436 . . . . 63.14 110.145 -178.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.97 -172.75 4.13 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 126.853 2.061 . . . . 74.24 107.999 173.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -129.51 114.69 16.42 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 125.212 1.405 . . . . 73.12 108.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 24.9 mt -98.97 24.39 7.81 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 127.651 2.38 . . . . 70.32 110.8 -176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 40.6 t -70.5 -22.64 62.63 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.05 1.34 . . . . 33.51 112.512 -177.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.9 m170 -125.41 12.6 8.14 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 124.509 1.123 . . . . 63.52 112.301 -171.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 7.2 p -90.84 140.42 16.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.257 0 CA-C-N 118.883 0.765 . . . . 70.43 109.314 176.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.404 ' NE2' HD21 ' A' ' 68' ' ' ASN . 0.0 OUTLIER -84.14 -36.2 23.09 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 122.287 -0.258 . . . . 62.22 111.183 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . 0.404 HD21 ' NE2' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -137.9 118.56 14.01 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 125.424 1.49 . . . . 72.24 107.303 -163.153 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -64.4 -39.14 93.27 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.171 0.804 . . . . 70.51 113.171 -168.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.6 -40.33 94.41 Favored 'General case' 0 C--O 1.219 -0.511 0 C-N-CA 124.884 1.274 . . . . 72.14 107.677 177.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.16 -19.3 65.21 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.857 0.753 . . . . 42.14 112.61 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -79.3 -51.24 9.7 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 122.15 0.976 . . . . 73.44 108.591 173.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.4 tp -59.73 -47.27 86.31 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.203 -1.362 . . . . 71.33 108.408 -173.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.6 p -59.91 -26.69 66.12 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 125.768 1.627 . . . . 63.35 110.411 -176.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.2 -53.05 5.36 Favored Glycine 0 C--N 1.34 0.768 0 N-CA-C 111.154 -0.779 . . . . 74.35 111.154 177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 86.9 t -57.23 -40.58 74.55 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 CA-C-N 117.375 0.587 . . . . 71.24 110.031 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.0 mtt -55.48 -45.08 77.01 Favored 'General case' 0 N--CA 1.464 0.268 0 O-C-N 121.358 -0.839 . . . . 62.31 111.073 175.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -63.5 -54.75 31.43 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 108.908 -0.775 . . . . 74.22 108.908 -171.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 5.3 t -63.83 -36.81 85.13 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 118.889 -0.577 . . . . 45.05 110.543 -178.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.512 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 2.4 m-85 -58.26 -44.73 88.52 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 120.14 1.336 . . . . 74.33 113.36 174.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -78.04 -11.51 59.91 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.253 0.479 . . . . 64.55 111.487 -178.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -130.43 75.14 1.64 Allowed 'General case' 0 C--O 1.236 0.369 0 C-N-CA 125.244 1.418 . . . . 65.34 109.155 177.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 37.0 ptt85 -122.68 0.4 9.29 Favored 'General case' 0 C--O 1.233 0.217 0 C-N-CA 124.789 1.236 . . . . 70.41 114.11 -176.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -65.62 160.1 23.33 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 108.169 -1.048 . . . . 74.54 108.169 157.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.255 1.371 0 N-CA-C 105.939 -1.875 . . . . 73.11 105.939 159.561 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.396 0 N-CA-C 111.442 -0.663 . . . . 65.51 111.442 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -132.43 -172.83 3.0 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 125.921 1.688 . . . . 73.25 110.579 -177.647 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -45.15 -44.15 10.47 Favored 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 127.483 2.313 . . . . 71.51 110.343 -175.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -58.76 -39.14 80.11 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 124.461 1.104 . . . . 74.52 110.317 -173.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -53.12 -57.96 8.67 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.269 1.027 . . . . 71.45 111.204 -175.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 36.4 tp60 -65.04 -39.05 92.77 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.25 -0.58 . . . . 72.45 110.554 -175.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.6 m -65.8 -36.79 84.51 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 118.168 0.44 . . . . 64.23 110.122 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.8 mt -63.13 -37.18 86.2 Favored 'General case' 0 C--N 1.34 0.179 0 O-C-N 120.816 -1.177 . . . . 70.45 111.105 174.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.509 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.2 mm? -65.52 -18.58 65.42 Favored 'General case' 0 C--O 1.232 0.147 0 CA-C-O 119.13 -0.462 . . . . 72.42 111.79 176.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -97.74 -14.16 21.0 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.778 0.831 . . . . 65.04 111.511 173.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.23 -0.34 14.1 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 126.033 1.733 . . . . 70.25 112.382 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 103.29 14.91 24.82 Favored Glycine 0 CA--C 1.527 0.797 0 CA-C-O 118.716 -1.047 . . . . 62.23 113.304 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.8 mt -113.12 152.44 45.03 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 118.927 1.364 . . . . 74.42 111.815 -166.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -71.3 160.41 48.89 Favored 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 123.005 2.47 . . . . 71.14 110.911 172.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.509 ' HA ' HD11 ' A' ' 9' ' ' LEU . 14.7 tt0 -64.43 -46.0 85.1 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 108.252 -1.018 . . . . 64.52 108.252 178.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.79 -38.11 74.92 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.568 0.951 . . . . 71.33 113.568 -170.779 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 57.7 t -78.63 -43.05 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.605 -1.257 . . . . 53.12 107.605 178.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.3 -32.32 56.2 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 118.968 0.804 . . . . 22.2 111.927 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -61.02 -23.25 65.27 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 114.367 1.247 . . . . 64.33 114.367 177.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.84 -6.14 20.51 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 118.947 0.794 . . . . 73.12 111.92 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.592 HD23 ' HE2' ' A' ' 25' ' ' TYR . 1.2 tt -104.66 -27.96 11.51 Favored 'General case' 0 C--O 1.224 -0.257 0 C-N-CA 124.762 1.225 . . . . 74.55 111.59 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -59.04 -41.86 88.86 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 119.314 0.961 . . . . 53.23 111.484 173.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -56.96 -24.24 51.61 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 125.232 1.413 . . . . 73.45 114.002 178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.423 ' CD1' HD22 ' A' ' 55' ' ' LEU . 11.0 mt -73.25 -18.12 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 C-N-CA 123.801 0.841 . . . . 73.25 109.436 -178.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.592 ' HE2' HD23 ' A' ' 21' ' ' LEU . 65.3 m-85 -99.79 -27.77 13.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 125.445 1.498 . . . . 74.11 112.651 175.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 71.3 t -58.87 -51.06 76.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-O 118.996 -0.526 . . . . 71.45 110.496 179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -84.08 0.88 46.61 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 113.93 1.085 . . . . 62.42 113.93 -162.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 44.34 87.96 Favored Glycine 0 CA--C 1.529 0.92 0 O-C-N 121.245 -0.909 . . . . 64.24 112.016 -176.566 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.495 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.4 mt -82.09 -74.59 0.34 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 126.552 1.941 . . . . 74.24 107.035 165.182 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.5 m -103.34 146.84 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 N-CA-C 113.83 1.048 . . . . 44.11 113.83 172.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.17 26.89 0.06 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 129.003 2.921 . . . . 72.34 116.46 -174.285 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . 0.303 2.9 p80 55.46 -21.24 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 128.828 2.851 . . . . 63.02 116.75 -165.815 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 72.1 p -129.14 16.55 6.15 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 120.447 1.476 . . . . 70.05 112.118 -178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.73 -15.41 58.46 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.299 1.44 . . . . 70.12 113.709 -173.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -89.14 170.41 10.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.619 1.568 . . . . 74.05 111.601 -160.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -105.45 158.51 16.61 Favored 'General case' 0 C--O 1.236 0.352 0 N-CA-C 108.831 -0.803 . . . . 64.01 108.831 176.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -47.59 -46.86 28.67 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 126.769 2.028 . . . . 52.24 110.45 -179.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 58.7 mtt180 -59.16 -35.19 73.09 Favored 'General case' 0 CA--C 1.51 -0.562 0 C-N-CA 122.987 0.515 . . . . 72.41 111.973 -176.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.83 -29.88 62.38 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-O 118.442 -0.79 . . . . 73.02 110.291 178.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 6.9 mm -71.79 -41.12 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 CA-C-N 119.593 1.088 . . . . 74.15 110.135 175.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -63.64 -58.59 6.46 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.867 -0.79 . . . . 73.1 108.867 175.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -52.85 -40.2 63.19 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.245 1.018 . . . . 70.32 111.471 -174.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.2 mt -46.99 -54.09 10.94 Favored 'General case' 0 C--N 1.339 0.128 0 C-N-CA 124.424 1.09 . . . . 62.41 111.541 173.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.64 -28.6 69.22 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.462 0.574 . . . . 72.22 111.773 179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -73.25 -16.22 61.4 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.479 -0.763 . . . . 65.03 112.441 -177.583 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -85.93 137.44 32.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 124.567 1.147 . . . . 74.53 110.937 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 17.8 p-10 -60.36 166.01 3.28 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-N 113.341 -1.754 . . . . 72.32 110.677 156.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -56.14 -58.16 9.12 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 113.946 -1.479 . . . . 72.22 110.553 -177.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.03 -30.95 70.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.874 0.369 . . . . 75.52 111.406 -178.655 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.26 -66.98 2.44 Favored Glycine 0 N--CA 1.445 -0.738 0 N-CA-C 108.564 -1.814 . . . . 54.04 108.564 171.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.5 -42.0 70.26 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 112.986 0.735 . . . . 51.2 112.986 -177.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.1 mt -59.14 -41.61 88.72 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 123.763 0.825 . . . . 72.54 111.405 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.432 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -73.1 -42.51 62.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 122.361 0.264 . . . . 42.4 110.812 176.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 70.0 t -54.28 -29.85 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 125.442 1.497 . . . . 71.21 110.27 175.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.561 HD21 HD12 ' A' ' 21' ' ' LEU . 13.7 mt -77.48 -54.52 6.32 Favored 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.36 1.064 . . . . 74.31 109.013 179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -56.76 -51.09 70.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 123.634 0.584 . . . . 71.44 109.869 -175.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -72.29 -7.5 49.8 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.267 0.84 . . . . 70.42 113.267 -172.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 85.2 t80 -93.64 -58.41 2.28 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 125.833 1.653 . . . . 72.22 110.216 174.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.0 OUTLIER -58.05 -33.37 68.93 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.591 1.156 . . . . 70.13 110.885 178.159 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 81.6 m-20 -76.77 52.33 0.83 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.247 1.819 . . . . 61.55 109.977 169.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.9 m -154.73 171.56 19.35 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 120.23 -1.544 . . . . 71.11 109.814 168.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -110.68 96.98 6.51 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.084 1.354 . . . . 64.45 107.673 -166.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 87.5 mt -89.65 -6.25 56.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 118.1 -0.952 . . . . 72.23 112.782 -164.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -45.84 -56.06 5.85 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 124.523 1.129 . . . . 73.31 111.722 -177.142 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -101.2 9.93 41.35 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.42 0.688 . . . . 72.21 112.415 -174.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 47.6 t -73.5 104.34 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 106.803 -1.555 . . . . 72.43 106.803 175.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.0 pm0 -62.67 -28.04 69.65 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.326 1.05 . . . . 72.41 113.251 -176.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -129.15 96.15 4.24 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 123.996 0.918 . . . . 73.12 108.639 177.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -54.27 -33.83 59.48 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 124.218 1.007 . . . . 73.02 109.999 172.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.1 m -69.66 -51.04 38.29 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 125.789 1.635 . . . . 74.25 111.39 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -58.27 -37.18 74.45 Favored 'General case' 0 C--N 1.341 0.218 0 CA-C-N 118.15 0.432 . . . . 74.22 110.393 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -64.73 -51.8 60.47 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 109.02 -0.733 . . . . 72.23 109.02 179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.3 tp -67.62 -58.09 5.3 Favored 'General case' 0 C--O 1.232 0.168 0 C-N-CA 124.628 1.171 . . . . 73.42 110.205 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -63.35 -22.54 66.94 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.601 -0.727 . . . . 74.12 110.983 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -74.42 -48.44 14.03 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-O 119.193 -0.782 . . . . 25.0 111.35 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 26.0 t -55.31 -45.19 77.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 118.453 1.126 . . . . 74.11 109.678 173.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.1 mtt -50.78 -51.41 50.81 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 118.471 0.578 . . . . 64.23 111.147 171.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -49.09 73.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 118.826 -0.607 . . . . 73.23 110.357 -174.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -61.74 -46.47 89.46 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 118.379 0.536 . . . . 42.12 110.8 175.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.432 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 1.5 m-85 -54.28 -52.63 60.82 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 118.76 0.709 . . . . 73.13 111.84 -175.234 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 26.8 ttp85 -67.92 -9.33 44.26 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.132 0.573 . . . . 71.14 111.493 -177.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mm100 -135.19 62.26 1.64 Allowed 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 126.379 1.872 . . . . 73.1 110.573 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -80.45 53.81 1.91 Allowed 'General case' 0 C--O 1.235 0.332 0 O-C-N 120.702 -1.249 . . . . 74.5 109.616 166.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.9 pt-20 -89.82 -175.64 4.69 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.011 -1.107 . . . . 73.23 108.011 150.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.6 mmmm . . . . . 0 CA--C 1.497 -1.078 0 N-CA-C 105.343 -2.095 . . . . 74.01 105.343 -169.767 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.484 0 N-CA-C 109.563 -1.415 . . . . 43.44 109.563 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.3 t -101.83 -178.39 3.7 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.461 0.648 . . . . 71.13 110.734 -172.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -61.91 -24.35 66.9 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 116.175 -0.466 . . . . 64.43 111.499 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -58.44 -40.84 83.66 Favored 'General case' 0 C--N 1.346 0.423 0 N-CA-C 109.022 -0.733 . . . . 71.15 109.022 -176.333 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -45.16 -53.44 8.09 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 124.853 1.261 . . . . 73.42 112.545 -175.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tp60 -65.47 -41.6 93.16 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 119.224 -0.417 . . . . 72.43 111.602 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -65.66 -31.43 72.44 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.475 0.71 . . . . 71.32 110.769 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.53 -40.55 76.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.884 -1.135 . . . . 70.12 110.268 174.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.421 HD11 ' HA ' ' A' ' 15' ' ' GLN . 1.1 mm? -62.14 -23.47 66.59 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 118.984 0.811 . . . . 62.34 111.579 176.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -82.82 -18.87 38.95 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 118.508 0.594 . . . . 53.02 111.647 177.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -78.38 -0.46 29.16 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 120.972 -1.08 . . . . 51.32 112.754 -161.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 102.7 7.09 45.67 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 124.429 1.014 . . . . 54.42 111.964 -171.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.0 mt -96.0 144.92 28.66 Favored Pre-proline 0 C--O 1.236 0.354 0 CA-C-N 118.504 1.152 . . . . 74.13 110.04 -172.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -68.72 163.21 38.02 Favored 'Trans proline' 0 N--CA 1.457 -0.625 0 C-N-CA 122.117 1.878 . . . . 61.4 110.228 167.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.421 ' HA ' HD11 ' A' ' 9' ' ' LEU . 27.1 tt0 -57.7 -48.12 80.45 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.312 -0.996 . . . . 73.44 108.312 177.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.527 ' HD3' HD11 ' A' ' 52' ' ' LEU . 0.1 OUTLIER -60.46 -31.45 70.45 Favored 'General case' 0 N--CA 1.442 -0.845 0 N-CA-C 112.896 0.702 . . . . 75.21 112.896 -169.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.6 t -81.15 -51.5 15.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 125.288 1.435 . . . . 71.5 108.591 176.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.41 -38.65 71.84 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.427 0.691 . . . . 73.53 111.98 -177.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.0 -48.1 52.64 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.804 1.642 . . . . 75.31 110.966 176.542 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.18 -29.29 31.58 Favored 'General case' 0 C--O 1.225 -0.197 0 C-N-CA 124.563 1.145 . . . . 72.54 110.465 -175.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.47 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -66.37 -42.83 87.44 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 119.419 1.008 . . . . 62.1 111.376 177.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -51.02 -41.52 59.86 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 124.337 1.055 . . . . 64.52 111.328 -173.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -53.29 -36.62 61.38 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 127.594 2.358 . . . . 75.2 112.712 177.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 22.4 mt -74.5 -14.07 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.093 0.957 . . . . 63.54 108.64 -174.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.47 ' CE2' HD23 ' A' ' 21' ' ' LEU . 45.2 m-85 -100.58 -8.95 22.47 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.792 1.637 . . . . 72.5 112.086 178.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 84.5 t -78.55 -34.5 17.96 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 125.496 1.518 . . . . 74.24 111.265 176.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.76 -3.89 58.19 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.235 1.198 . . . . 51.24 114.235 -161.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 63.97 28.9 73.45 Favored Glycine 0 CA--C 1.533 1.198 0 O-C-N 121.363 -0.836 . . . . 74.44 111.46 -163.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 9.0 mt -71.36 -81.94 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 128.253 2.621 . . . . 74.51 105.783 162.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 4.0 m -124.71 176.79 5.32 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 C-N-CA 123.724 0.81 . . . . 71.12 111.48 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.37 155.25 20.21 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 125.184 1.393 . . . . 74.34 108.044 166.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.1 p-80 -48.77 -32.32 8.41 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.605 1.562 . . . . 71.33 112.343 -179.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -86.07 5.88 31.55 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 126.998 2.119 . . . . 71.1 113.47 -175.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.82 -15.21 63.44 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 119.276 -2.14 . . . . 72.5 114.522 -177.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 96.6 mt -95.89 136.94 35.66 Favored 'General case' 0 C--O 1.233 0.206 0 C-N-CA 123.753 0.821 . . . . 73.42 111.729 -167.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -70.79 155.33 40.92 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 107.136 -1.431 . . . . 73.42 107.136 171.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -60.12 -32.6 71.16 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.787 -0.57 . . . . 71.54 110.961 178.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 19.5 mtm180 -61.89 -29.63 70.33 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 123.684 0.794 . . . . 73.14 112.773 175.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.97 -35.87 31.54 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 109.644 -0.502 . . . . 73.34 109.644 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 31.1 mm -60.86 -43.26 95.25 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-N 118.657 0.662 . . . . 70.41 109.28 172.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -54.24 -55.85 24.05 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.431 1.092 . . . . 70.11 110.244 171.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.97 -37.76 74.77 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 119.224 -0.417 . . . . 54.03 111.743 -177.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 10.3 mt -56.69 -42.28 78.81 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 123.479 0.712 . . . . 74.24 111.596 178.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.92 -25.89 67.08 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 118.627 0.648 . . . . 74.51 112.585 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -75.87 -13.28 60.27 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 120.007 1.276 . . . . 64.21 113.118 -173.318 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -90.69 135.53 33.65 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.514 1.526 . . . . 54.1 108.714 178.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.6 p-10 -65.97 170.01 6.06 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-N 115.278 -0.873 . . . . 54.14 110.595 163.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.2 tt0 -46.78 -64.39 0.78 Allowed 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 126.997 2.119 . . . . 73.42 111.52 179.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -64.15 -36.69 84.85 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 123.009 0.524 . . . . 74.23 111.817 -176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -64.87 -46.36 89.72 Favored Glycine 0 C--N 1.34 0.797 0 N-CA-C 110.617 -0.993 . . . . 54.32 110.617 -179.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.56 82.01 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.932 1.693 . . . . 73.51 110.395 178.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.527 HD11 ' HD3' ' A' ' 16' ' ' LYS . 48.0 mt -55.19 -45.63 75.81 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 118.713 0.688 . . . . 74.5 110.362 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.87 -46.15 82.02 Favored 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.74 0.274 . . . . 72.22 111.74 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.402 HG11 ' HG3' ' A' ' 77' ' ' MET . 41.9 t -56.64 -41.94 75.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 124.29 1.036 . . . . 74.5 110.564 175.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 59.4 mt -68.15 -43.29 78.61 Favored 'General case' 0 C--O 1.236 0.358 0 O-C-N 121.668 -0.645 . . . . 74.41 110.213 -174.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -62.93 -39.81 95.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.384 -0.969 . . . . 71.23 108.384 -176.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -74.19 -31.14 62.54 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 118.273 0.488 . . . . 75.4 111.231 -178.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -59.71 -57.99 10.51 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 122.916 0.486 . . . . 73.41 109.892 175.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.54 -21.97 66.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 118.336 -0.84 . . . . 74.43 112.105 -179.64 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.2 m-20 -74.99 49.01 0.41 Allowed 'General case' 0 CA--C 1.547 0.863 0 CA-C-N 119.42 1.009 . . . . 62.44 109.564 164.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.7 m -152.52 150.05 29.17 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.362 1.465 . . . . 52.31 111.566 172.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -97.58 87.21 4.02 Favored 'General case' 0 C--N 1.339 0.133 0 CA-C-O 122.946 1.355 . . . . 71.3 109.617 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.5 mt -76.76 46.33 0.45 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.619 1.968 . . . . 43.4 111.378 -172.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 8.8 m -95.04 -5.46 44.38 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 125.526 1.531 . . . . 64.53 112.607 167.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 46.7 m170 -125.72 41.2 3.57 Favored 'General case' 0 N--CA 1.472 0.64 0 O-C-N 120.498 -1.376 . . . . 70.11 111.463 -175.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -134.69 100.58 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 C-N-CA 124.899 1.279 . . . . 74.33 109.959 -168.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.582 ' H ' ' NE2' ' A' ' 67' ' ' GLN . 1.3 pm0 -65.69 -47.07 76.67 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.32 1.048 . . . . 74.13 112.599 176.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 69.4 m-20 -107.43 99.03 8.57 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 106.589 -1.634 . . . . 65.44 106.589 178.288 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -60.35 -34.72 74.24 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.079 0.466 . . . . 74.42 109.964 177.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 72.5 p -64.71 -55.53 19.37 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.634 1.174 . . . . 61.33 110.659 178.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.88 -26.73 67.63 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 119.081 -0.485 . . . . 73.24 112.028 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -63.31 -54.34 38.55 Favored 'General case' 0 C--O 1.231 0.097 0 CA-C-N 118.696 0.68 . . . . 72.23 109.866 173.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.7 tp -58.72 -52.88 63.8 Favored 'General case' 0 CA--C 1.521 -0.163 0 C-N-CA 123.967 0.907 . . . . 74.4 109.613 -178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.11 -29.29 65.38 Favored 'General case' 0 CA--C 1.537 0.481 0 CA-C-N 115.749 -0.66 . . . . 54.32 112.194 176.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.61 -39.15 90.71 Favored Glycine 0 CA--C 1.527 0.825 0 C-N-CA 124.708 1.147 . . . . 64.4 112.263 175.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 94.9 t -64.67 -48.52 84.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 N-CA-C 107.67 -1.233 . . . . 74.43 107.67 171.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.402 ' HG3' HG11 ' A' ' 54' ' ' VAL . 6.0 mtp -58.52 -33.14 69.52 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 121.011 -1.056 . . . . 71.4 112.297 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -58.05 -58.15 9.7 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 108.84 -0.8 . . . . 70.4 108.84 177.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 14.9 t -62.49 -50.1 72.73 Favored 'General case' 0 C--O 1.22 -0.47 0 CA-C-O 118.934 -0.555 . . . . 74.12 110.157 178.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -49.14 -28.66 4.51 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 117.475 2.398 . . . . 65.24 117.475 -176.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -115.28 0.24 13.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.337 0.971 . . . . 63.5 112.659 176.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -127.68 74.61 1.54 Allowed 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 126.738 2.015 . . . . 72.32 108.799 159.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 30.3 ptt85 -124.64 7.79 8.23 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.961 1.304 . . . . 75.43 112.688 -177.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -90.63 49.87 1.73 Allowed 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 127.878 2.471 . . . . 52.44 110.052 178.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.9 mmtm . . . . . 0 C--O 1.247 0.946 0 C-N-CA 125.538 1.535 . . . . 72.22 110.448 179.797 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.775 0 N-CA-C 110.569 -1.013 . . . . 62.15 110.569 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.3 m -127.16 -165.37 1.46 Allowed 'General case' 0 C--O 1.232 0.168 0 C-N-CA 123.985 0.914 . . . . 74.53 110.755 -173.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.7 pm0 -55.07 -28.95 56.26 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 113.921 1.082 . . . . 73.55 113.921 -166.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -64.14 -34.65 78.54 Favored 'General case' 0 N--CA 1.461 0.103 0 C-N-CA 123.525 0.73 . . . . 71.43 110.447 -177.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -54.79 -47.53 73.85 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 124.491 1.116 . . . . 74.32 110.348 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 29.7 tp60 -62.26 -49.48 75.51 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 118.947 -0.549 . . . . 71.53 110.378 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.0 m -55.08 -49.55 71.4 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.425 1.09 . . . . 70.45 109.703 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 19.4 mt -65.8 -39.2 90.69 Favored 'General case' 0 N--CA 1.457 -0.119 0 O-C-N 121.67 -0.644 . . . . 72.15 111.257 -177.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -64.13 -15.13 59.09 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 118.768 -0.634 . . . . 72.43 111.522 175.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -105.77 2.35 27.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 125.895 1.678 . . . . 74.23 112.711 175.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -96.95 24.3 6.35 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.039 1.336 . . . . 71.34 111.861 -177.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.95 16.9 78.29 Favored Glycine 0 CA--C 1.525 0.692 0 O-C-N 121.18 -0.95 . . . . 62.15 112.979 -177.57 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.1 mt -111.02 156.82 40.26 Favored Pre-proline 0 CA--C 1.538 0.495 0 CA-C-N 118.65 1.225 . . . . 72.51 111.371 -173.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.82 173.92 13.69 Favored 'Trans proline' 0 CA--C 1.541 0.833 0 C-N-CA 124.259 3.306 . . . . 63.44 113.917 175.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -76.68 -46.01 27.34 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 126.377 1.871 . . . . 73.55 111.055 -178.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 1.2 tmtm? -57.37 -42.08 81.41 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 118.948 0.794 . . . . 65.25 111.34 -176.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 90.3 t -58.49 -63.28 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 C-N-CA 125.017 1.327 . . . . 72.11 108.107 168.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.21 -47.27 24.44 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.161 1.385 . . . . 71.53 112.012 -171.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -53.01 -56.9 12.59 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.624 1.569 . . . . 71.03 110.828 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -67.4 -38.65 85.01 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 109.907 -0.405 . . . . 50.43 109.907 -179.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.5 tp -72.22 -42.65 65.5 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.206 1.402 . . . . 70.54 110.976 -168.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -49.82 -50.52 44.83 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 126.017 1.727 . . . . 73.55 110.461 172.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.9 mm-40 -62.17 -16.3 52.02 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 125.947 1.699 . . . . 73.25 113.617 -178.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.2 mt -73.75 -31.38 31.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 O-C-N 120.994 -1.066 . . . . 64.5 108.707 175.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.3 m-85 -85.39 -48.38 9.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.882 0.873 . . . . 74.55 110.228 -177.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.4 t -53.83 -39.53 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 C-N-CA 123.58 0.752 . . . . 73.23 111.758 -175.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -70.75 0.31 7.35 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.129 0.971 . . . . 73.22 112.888 -175.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 88.83 7.01 71.63 Favored Glycine 0 CA--C 1.524 0.615 0 C-N-CA 125.327 1.442 . . . . 63.3 112.793 174.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.59 HD12 ' HE2' ' A' ' 59' ' ' LYS . 39.8 mt -75.91 -59.8 2.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 118.13 0.965 . . . . 74.13 109.704 -166.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.7 m -128.7 167.25 24.33 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.24 1.016 . . . . 70.22 112.248 179.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.2 155.26 27.47 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 123.774 0.829 . . . . 71.2 109.779 171.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -73.8 -38.18 64.7 Favored 'General case' 0 N--CA 1.462 0.173 0 O-C-N 121.949 -0.469 . . . . 72.31 110.661 175.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.33 7.72 9.0 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 118.72 0.691 . . . . 72.22 112.395 -179.16 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -76.02 -4.36 40.84 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 113.991 1.108 . . . . 73.13 113.991 -166.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.492 ' N ' HD22 ' A' ' 35' ' ' LEU . 0.3 OUTLIER -107.46 169.44 8.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 124.727 1.211 . . . . 73.41 110.325 -175.832 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -108.36 172.11 7.02 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 125.27 1.428 . . . . 74.34 109.836 -173.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -52.1 -44.64 64.52 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.037 1.335 . . . . 74.41 111.344 179.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 33.6 ptt180 -57.56 -22.84 47.12 Favored 'General case' 0 C--N 1.334 -0.075 0 C-N-CA 125.795 1.638 . . . . 73.4 113.673 175.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -80.2 -36.38 34.96 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 117.939 -1.029 . . . . 74.33 110.283 174.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.8 mm -63.41 -59.75 3.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 108.218 -1.031 . . . . 74.14 108.218 172.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.3 tt0 -58.98 -47.55 84.75 Favored 'General case' 0 N--CA 1.452 -0.342 0 C-N-CA 124.231 1.012 . . . . 70.2 111.189 -170.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.39 -30.14 66.96 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 118.012 -0.994 . . . . 71.44 111.712 -176.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.3 -38.35 65.82 Favored 'General case' 0 C--N 1.342 0.282 0 CA-C-N 119.728 1.149 . . . . 65.5 111.204 170.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.2 mmmp? -64.01 -26.42 68.56 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 118.777 0.717 . . . . 74.21 111.525 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -74.88 -18.04 60.49 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.685 -0.634 . . . . 74.43 112.051 179.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -88.52 140.5 29.4 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 122.203 1.001 . . . . 71.34 109.521 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 4.4 p30 -69.23 176.22 3.42 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.27 -1.332 . . . . 70.14 109.367 162.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.9 tt0 -54.76 -59.28 4.93 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 114.22 -1.354 . . . . 74.25 111.673 -177.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.56 -27.89 45.91 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 119.64 -0.219 . . . . 51.52 110.972 -170.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -62.17 -48.96 79.29 Favored Glycine 0 C--N 1.337 0.608 0 N-CA-C 109.424 -1.47 . . . . 65.24 109.424 171.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.84 -43.99 94.33 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 117.807 0.803 . . . . 72.13 110.576 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -63.91 -36.29 83.47 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.5 -0.75 . . . . 54.34 112.012 179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.85 -43.85 82.56 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 119.029 0.831 . . . . 72.1 110.517 175.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 65.5 t -55.07 -42.09 62.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 123.255 0.622 . . . . 64.51 109.729 174.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.3 mt -76.42 -38.06 56.14 Favored 'General case' 0 C--O 1.234 0.254 0 O-C-N 121.77 -0.581 . . . . 61.41 111.653 -175.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -67.45 -28.85 68.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.727 -0.654 . . . . 62.32 110.617 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -75.42 -36.28 60.82 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.925 0.784 . . . . 73.43 110.48 171.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -56.48 -57.74 11.03 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 123.976 0.91 . . . . 72.3 111.63 -175.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.59 ' HE2' HD12 ' A' ' 29' ' ' LEU . 34.0 ttmt -63.54 -30.15 71.31 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 118.548 0.613 . . . . 71.44 111.46 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -73.83 10.23 1.22 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.323 1.449 . . . . 74.03 113.117 -172.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 31.2 m -112.57 165.98 11.75 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.486 1.514 . . . . 61.32 111.666 -173.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -95.99 105.54 17.59 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 107.713 -1.218 . . . . 71.33 107.713 -176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.541 ' HB3' ' HE3' ' A' ' 69' ' ' LYS . 91.8 mt -92.22 -7.28 48.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.698 -0.683 . . . . 72.14 112.823 -171.451 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.6 m -60.29 -27.01 66.95 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 115.433 1.642 . . . . 61.34 115.433 -169.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 24.5 m80 -131.72 16.11 4.82 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.344 1.057 . . . . 62.22 111.439 -170.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 27.0 t -64.04 154.28 6.81 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.573 1.149 . . . . 51.01 109.966 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.5 -63.64 1.24 Allowed 'General case' 0 N--CA 1.455 -0.184 0 CA-C-N 116.374 -0.376 . . . . 74.4 110.355 -178.291 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -127.1 134.76 50.18 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 106.638 -1.616 . . . . 52.4 106.638 166.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.541 ' HE3' ' HB3' ' A' ' 63' ' ' LEU . 29.8 mmtm -59.57 -27.4 66.21 Favored 'General case' 0 N--CA 1.448 -0.538 0 O-C-N 124.084 0.865 . . . . 61.22 111.051 172.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 84.7 p -72.66 -53.08 12.77 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.473 0.709 . . . . 70.44 110.398 176.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -53.96 -38.91 65.47 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 122.8 0.44 . . . . 64.2 111.425 -179.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 24.1 t80 -60.05 -51.78 68.17 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.732 0.777 . . . . 65.41 109.531 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 21.9 tp -62.17 -52.07 65.29 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.705 -0.85 . . . . 73.32 108.705 -176.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 11.9 t -57.65 -28.22 63.53 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.03 0.932 . . . . 62.24 111.448 -179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.43 -49.6 50.21 Favored Glycine 0 CA--C 1.526 0.767 0 N-CA-C 111.16 -0.776 . . . . 30.12 111.16 175.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 96.6 t -61.94 -37.85 79.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 117.826 0.813 . . . . 74.13 111.254 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 52.2 mtt -55.21 -44.83 75.76 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 121.0 -1.063 . . . . 64.2 111.09 176.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.4 mptt -58.5 -50.68 72.86 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.01 0.924 . . . . 73.41 110.723 -174.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 6.0 t -68.63 -36.35 78.51 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-O 117.605 -1.188 . . . . 63.54 111.112 178.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -65.23 -31.11 72.1 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 122.245 2.293 . . . . 63.2 112.798 174.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 10.9 mmm-85 -69.52 -28.19 65.82 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 121.173 -0.954 . . . . 73.5 111.279 172.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -141.39 81.86 1.8 Allowed 'General case' 0 C--O 1.241 0.65 0 C-N-CA 125.857 1.663 . . . . 63.43 110.471 -176.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.6 ttt180 -132.5 82.11 1.99 Allowed 'General case' 0 N--CA 1.448 -0.558 0 N-CA-C 105.318 -2.105 . . . . 65.04 105.318 169.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -132.38 172.48 12.41 Favored 'General case' 0 C--N 1.319 -0.74 0 C-N-CA 125.898 1.679 . . . . 73.31 109.561 175.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.426 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 7.6 mmpt? . . . . . 0 C--O 1.249 1.041 0 C-N-CA 128.97 2.908 . . . . 73.31 110.114 -175.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.552 0 N-CA-C 110.564 -1.014 . . . . 55.55 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.55 -179.97 7.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.675 1.226 . . . . 75.22 110.476 174.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.2 -28.97 67.13 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 114.733 -1.121 . . . . 74.03 112.219 177.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -52.71 -31.35 37.22 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.865 1.266 . . . . 60.35 112.86 -177.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -55.4 -42.82 74.59 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 123.264 0.626 . . . . 74.25 110.948 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -64.27 -46.44 83.68 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.279 1.031 . . . . 73.21 111.999 -178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -70.24 -30.36 67.4 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.022 0.828 . . . . 70.25 110.365 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.58 -47.87 79.73 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 120.86 -1.15 . . . . 63.22 109.505 172.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.504 HD21 ' HA ' ' A' ' 15' ' ' GLN . 29.0 mt -65.25 -15.04 62.06 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 123.928 0.891 . . . . 61.11 113.175 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -87.88 -42.14 12.72 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 126.501 1.92 . . . . 44.15 110.431 174.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -68.16 15.81 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 128.684 2.794 . . . . 74.14 112.902 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 77.35 12.33 84.66 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 127.174 2.321 . . . . 54.21 112.641 175.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.8 mt -85.71 145.98 42.84 Favored Pre-proline 0 C--O 1.237 0.417 0 CA-C-N 118.424 1.112 . . . . 41.41 108.908 -179.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -71.02 167.75 25.18 Favored 'Trans proline' 0 N--CA 1.455 -0.738 0 C-N-CA 122.578 2.186 . . . . 53.45 112.478 175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.504 ' HA ' HD21 ' A' ' 9' ' ' LEU . 46.6 tt0 -70.84 -48.07 55.93 Favored 'General case' 0 CA--C 1.504 -0.817 0 C-N-CA 124.974 1.309 . . . . 70.33 110.053 -174.05 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 5.0 tmtt? -62.45 -40.15 95.67 Favored 'General case' 0 N--CA 1.439 -1.015 0 C-N-CA 119.457 -0.897 . . . . 50.41 111.107 -172.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 76.6 t -60.53 -57.07 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 N-CA-C 108.178 -1.045 . . . . 72.15 108.178 172.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.72 -42.1 62.02 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 124.411 1.085 . . . . 61.03 113.55 -178.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -56.12 -52.34 64.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.96 0.904 . . . . 73.51 110.566 178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.13 -28.58 62.34 Favored 'General case' 0 N--CA 1.461 0.085 0 O-C-N 121.694 -0.629 . . . . 74.24 110.144 -178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.541 HD23 ' CE2' ' A' ' 25' ' ' TYR . 0.0 OUTLIER -68.23 -35.24 77.65 Favored 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 118.731 0.696 . . . . 74.23 111.28 -179.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -53.03 -43.43 66.57 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 124.731 1.213 . . . . 64.45 111.57 179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -64.57 -15.34 60.89 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 125.633 1.573 . . . . 72.55 113.883 175.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.4 mt -76.5 -42.52 35.48 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.475 0 N-CA-C 107.921 -1.14 . . . . 71.42 107.921 172.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.541 ' CE2' HD23 ' A' ' 21' ' ' LEU . 53.2 m-85 -84.39 -10.47 57.53 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 113.586 0.958 . . . . 74.32 113.586 -172.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 96.4 t -86.59 -19.92 7.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.572 0 CA-C-N 119.081 0.855 . . . . 72.34 110.576 170.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -87.64 7.26 30.71 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.272 -0.893 . . . . 61.41 113.371 -165.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.19 5.55 48.95 Favored Glycine 0 CA--C 1.529 0.919 0 O-C-N 121.31 -0.869 . . . . 54.34 113.848 -175.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.9 mt -77.1 -61.08 2.1 Favored 'General case' 0 C--O 1.231 0.129 0 CA-C-N 118.805 1.302 . . . . 62.21 109.15 -174.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.2 m -130.14 -174.25 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 123.664 0.785 . . . . 63.13 110.634 176.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -124.65 154.96 39.96 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 127.499 2.32 . . . . 73.41 107.585 176.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -57.91 -19.47 30.04 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.699 1.0 . . . . 72.35 113.699 -174.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.2 t -104.41 15.35 28.38 Favored 'General case' 0 CA--C 1.546 0.814 0 O-C-N 120.832 -1.167 . . . . 64.43 111.871 179.424 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -67.41 -18.48 65.13 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 119.92 -1.737 . . . . 71.22 114.228 178.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 70' ' ' SER . 85.2 mt -90.58 167.81 12.27 Favored 'General case' 0 C--O 1.233 0.187 0 C-N-CA 123.703 0.801 . . . . 75.32 111.59 -171.751 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -101.97 156.84 17.28 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 106.629 -1.619 . . . . 55.45 106.629 171.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 21.6 tt0 -64.35 -30.02 71.08 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.564 -0.71 . . . . 70.44 110.27 177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 2.0 mmp_? -55.12 -22.48 16.83 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.446 1.098 . . . . 64.25 113.611 170.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -92.94 -44.52 8.4 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.004 1.322 . . . . 73.35 110.925 176.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 33.8 mm -56.25 -42.53 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 CA-C-N 119.146 0.885 . . . . 43.11 109.36 -178.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -51.09 -49.3 60.96 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.498 1.119 . . . . 74.22 111.135 173.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.1 -38.8 92.37 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 122.903 0.481 . . . . 63.02 110.092 -172.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.8 mt -58.44 -34.19 70.55 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 112.598 0.592 . . . . 73.12 112.598 176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 15.4 mmtm -60.54 -26.99 67.3 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 119.126 -0.464 . . . . 71.31 111.54 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -80.13 -18.19 50.5 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 113.81 1.041 . . . . 72.21 113.81 -168.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 67.5 m-85 -87.12 155.41 20.13 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 125.008 1.323 . . . . 72.35 110.006 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 10.7 p-10 -79.56 -177.66 5.93 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 125.273 1.429 . . . . 74.11 110.397 168.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -52.14 -70.86 0.08 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 126.109 1.764 . . . . 73.54 110.492 178.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 55.1 t0 -60.92 -45.59 94.05 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 124.886 1.275 . . . . 75.45 109.994 -174.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.564 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -55.78 -54.7 33.22 Favored Glycine 0 C--N 1.341 0.86 0 N-CA-C 110.207 -1.157 . . . . 52.01 110.207 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.94 -49.57 76.32 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 117.882 0.841 . . . . 65.45 110.672 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -53.61 -41.54 66.76 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.207 1.003 . . . . 75.41 110.815 178.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.03 -48.98 79.65 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 117.882 0.31 . . . . 74.13 110.505 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.564 HG23 ' O ' ' A' ' 50' ' ' GLY . 11.0 t -58.97 -34.99 54.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 C-N-CA 124.474 1.109 . . . . 74.54 110.471 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.9 -43.24 83.91 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 123.498 0.719 . . . . 75.21 109.985 -176.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.3 -43.97 92.58 Favored 'General case' 0 CA--C 1.532 0.285 0 N-CA-C 107.122 -1.436 . . . . 72.23 107.122 -177.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -76.3 -33.71 59.06 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 109.488 -0.56 . . . . 62.41 109.488 -168.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -60.15 -62.7 1.68 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.471 1.108 . . . . 72.35 110.785 171.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.52 -44.54 62.62 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.967 1.707 . . . . 74.43 111.701 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -75.22 15.05 0.47 Allowed 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.852 1.261 . . . . 74.21 113.47 -173.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 48.7 m -112.53 173.68 6.26 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.478 1.511 . . . . 52.03 111.383 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -103.41 123.94 47.79 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 106.498 -1.667 . . . . 63.51 106.498 -175.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 77.8 mt -105.68 -9.55 17.26 Favored 'General case' 0 C--N 1.319 -0.745 0 C-N-CA 125.256 1.423 . . . . 74.21 112.242 -171.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.5 m -56.68 -26.81 57.43 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.717 2.007 . . . . 75.32 114.637 -177.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 56.1 m80 -122.91 11.57 9.64 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.573 1.149 . . . . 72.42 110.924 178.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.7 t -71.38 127.83 33.79 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.2 0 O-C-N 120.891 -1.13 . . . . 75.33 108.205 171.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 20.0 mt-30 -64.29 -56.73 12.51 Favored 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.136 1.775 . . . . 52.43 110.379 -175.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 66.4 m-80 -128.77 126.01 39.05 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 105.291 -2.114 . . . . 75.33 105.291 178.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -60.96 -27.78 68.5 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 123.558 0.536 . . . . 73.43 111.629 179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . 0.402 ' HB3' ' HA ' ' A' ' 35' ' ' LEU . 12.4 p -73.77 -54.05 8.92 Favored 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 127.127 2.171 . . . . 73.43 110.81 177.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -56.53 -32.01 64.69 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 118.356 0.525 . . . . 71.32 111.984 -177.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 35.4 t80 -67.21 -46.5 73.68 Favored 'General case' 0 C--N 1.34 0.169 0 CA-C-O 120.603 0.24 . . . . 61.22 110.535 177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 16.5 tp -62.54 -42.88 99.81 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 122.811 0.444 . . . . 73.35 110.171 178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.3 m -57.64 -28.4 63.67 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 118.14 -0.933 . . . . 72.52 112.557 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.6 -55.98 6.33 Favored Glycine 0 CA--C 1.528 0.87 0 C-N-CA 124.356 0.979 . . . . 21.52 111.907 176.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 22.4 t -62.05 -39.97 85.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 CA-C-N 118.023 0.911 . . . . 71.53 109.863 -173.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 28.7 mtm -57.21 -42.1 80.7 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 120.483 -1.385 . . . . 61.34 111.491 172.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -61.76 -38.86 89.58 Favored 'General case' 0 C--N 1.333 -0.132 0 O-C-N 121.79 -0.569 . . . . 74.12 110.654 -177.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -50.89 61.28 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 118.371 -0.823 . . . . 72.24 110.515 176.34 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.556 ' CG ' HG22 ' A' ' 54' ' ' VAL . 11.5 m-85 -54.22 -32.68 56.46 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 113.557 0.947 . . . . 72.53 113.557 177.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -13.53 61.24 Favored 'General case' 0 N--CA 1.464 0.232 0 N-CA-C 114.227 1.195 . . . . 72.21 114.227 175.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -131.18 73.9 1.57 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 125.053 1.341 . . . . 73.11 108.497 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 64.9 mtp85 -140.29 24.69 2.29 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 127.819 2.448 . . . . 74.35 110.002 175.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.18 94.35 1.54 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.992 0.917 . . . . 45.31 108.818 172.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.968 0 C-N-CA 127.537 2.335 . . . . 61.32 104.918 173.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.698 0 N-CA-C 110.287 -1.125 . . . . 61.02 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.9 m -119.43 178.9 4.37 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 123.555 0.742 . . . . 61.31 110.845 177.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -31.98 46.18 Favored 'General case' 0 N--CA 1.463 0.195 0 C-N-CA 124.726 1.211 . . . . 75.42 113.769 -176.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 3.9 p30 -57.85 -33.9 69.15 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.358 1.063 . . . . 63.34 111.739 -179.044 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -52.84 -56.72 13.74 Favored 'General case' 0 C--N 1.344 0.331 0 C-N-CA 124.298 1.039 . . . . 75.41 111.657 -172.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -57.93 -32.33 67.68 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.636 0.775 . . . . 75.1 111.536 178.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 18.0 m -67.18 -33.64 75.83 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 117.917 -1.039 . . . . 73.21 110.907 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.623 ' HG ' HD22 ' A' ' 21' ' ' LEU . 0.4 OUTLIER -62.48 -39.81 94.64 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 121.698 2.044 . . . . 73.24 110.189 175.671 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' A' ' 15' ' ' GLN . 2.9 mm? -66.51 -16.56 64.23 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.502 0.721 . . . . 71.41 112.076 178.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -93.51 -39.4 10.89 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.498 1.919 . . . . 72.32 109.728 177.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.417 ' O ' ' HE2' ' A' ' 44' ' ' LYS . . . -70.35 8.0 0.9 Allowed 'General case' 0 C--O 1.234 0.244 0 C-N-CA 129.805 3.242 . . . . 72.13 112.913 -174.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 109.47 -0.37 30.9 Favored Glycine 0 N--CA 1.439 -1.158 0 C-N-CA 124.979 1.276 . . . . 73.13 113.577 172.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 31.4 mt -105.3 154.76 38.71 Favored Pre-proline 0 C--O 1.235 0.322 0 CA-C-N 119.275 1.537 . . . . 72.0 112.329 -162.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -78.63 172.76 14.65 Favored 'Trans proline' 0 N--CA 1.454 -0.795 0 C-N-CA 123.066 2.51 . . . . 62.41 111.789 174.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.459 ' HA ' HD11 ' A' ' 9' ' ' LEU . 0.2 OUTLIER -74.24 -42.46 59.67 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 118.219 -0.896 . . . . 62.04 110.712 -174.09 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -64.72 -41.62 95.84 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 118.732 -1.187 . . . . 64.44 110.565 -167.213 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.9 t -58.07 -56.46 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 C-N-CA 125.59 1.556 . . . . 55.1 108.739 168.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.64 -37.16 67.85 Favored 'General case' 0 N--CA 1.467 0.409 0 N-CA-C 113.037 0.754 . . . . 53.52 113.037 -175.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.426 ' C ' ' HE3' ' A' ' 20' ' ' LYS . 3.8 mt-10 -63.33 -20.66 65.7 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 124.264 1.026 . . . . 73.02 112.744 179.261 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HE3' ' C ' ' A' ' 19' ' ' GLU . 0.1 OUTLIER -98.25 -32.48 11.54 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.23 0.923 . . . . 74.24 110.46 170.127 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.731 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.3 OUTLIER -68.17 -31.67 71.38 Favored 'General case' 0 C--O 1.223 -0.339 0 C-N-CA 125.116 1.366 . . . . 64.32 111.129 -175.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t0 -54.52 -51.17 65.98 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 126.193 1.797 . . . . 71.22 112.033 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.91 -34.52 28.76 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.672 2.389 . . . . 52.22 112.503 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 33.9 mt -63.42 -28.17 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 N-CA-C 108.447 -0.946 . . . . 73.42 108.447 -175.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.731 ' HE2' HD23 ' A' ' 21' ' ' LEU . 34.6 m-85 -104.42 13.11 32.52 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.804 1.642 . . . . 74.14 112.805 178.237 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 61.6 t -111.06 -36.18 2.69 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.306 1.042 . . . . 73.21 109.912 173.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.93 9.62 3.45 Favored 'General case' 0 CA--C 1.531 0.231 0 O-C-N 121.009 -1.057 . . . . 74.15 112.981 -174.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 70.03 11.46 66.89 Favored Glycine 0 CA--C 1.526 0.761 0 CA-C-O 118.999 -0.889 . . . . 64.35 113.147 -178.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.495 HD12 ' HE2' ' A' ' 59' ' ' LYS . 88.6 mt -66.12 -65.85 0.62 Allowed 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 118.522 1.161 . . . . 61.45 108.121 178.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.424 HG23 ' CE1' ' A' ' 25' ' ' TYR . 27.3 m -135.45 164.02 34.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 O-C-N 123.238 0.336 . . . . 75.42 111.213 -173.674 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -90.15 155.2 19.2 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 124.208 1.003 . . . . 75.41 110.269 175.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -63.01 -23.81 67.63 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.259 -0.901 . . . . 63.34 112.209 178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.7 m -100.5 12.88 36.32 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.76 1.022 . . . . 73.32 113.76 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -72.22 -26.35 62.0 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.601 -1.312 . . . . 75.44 112.579 -179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 26.9 mt -76.51 156.57 32.84 Favored 'General case' 0 CA--C 1.521 -0.167 0 C-N-CA 123.381 0.672 . . . . 71.35 110.835 178.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -110.25 173.59 6.26 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 125.834 1.653 . . . . 73.03 108.996 171.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -35.76 75.75 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.76 -0.654 . . . . 75.31 111.322 -164.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 13.1 mtp-105 -66.02 -20.43 66.18 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-O 118.504 -0.76 . . . . 75.31 111.975 -176.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.54 -34.64 18.52 Favored 'General case' 0 N--CA 1.454 -0.241 0 CA-C-N 119.309 0.959 . . . . 72.44 110.797 176.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.3 mm -67.09 -38.94 82.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 108.344 -0.984 . . . . 72.04 108.344 174.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 61.7 tt0 -61.59 -45.56 93.58 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.481 -0.762 . . . . 74.32 110.473 172.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.13 -42.85 95.68 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-O 119.273 -0.394 . . . . 64.03 111.48 179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 11.9 mt -55.82 -49.08 74.23 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.978 0.911 . . . . 74.41 111.447 179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.417 ' HE2' ' O ' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -53.23 -19.53 3.21 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.818 1.647 . . . . 72.12 113.931 178.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -87.57 -20.36 26.55 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 120.168 1.349 . . . . 75.31 114.224 -170.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -90.0 152.38 21.22 Favored 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 124.141 0.976 . . . . 71.05 111.127 -165.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -74.03 -175.51 2.22 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 114.486 -1.234 . . . . 74.01 110.337 164.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -53.37 -68.0 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 124.71 1.204 . . . . 75.03 112.089 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -72.04 -35.3 69.31 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.086 -0.709 . . . . 73.41 109.086 -173.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -53.99 -46.12 70.02 Favored Glycine 0 CA--C 1.528 0.89 0 N-CA-C 110.93 -0.868 . . . . 75.12 110.93 174.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -67.17 -51.53 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 118.365 -0.826 . . . . 75.33 109.686 177.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -54.07 -43.45 70.29 Favored 'General case' 0 C--O 1.225 -0.232 0 C-N-CA 124.01 0.924 . . . . 74.41 111.478 -178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.24 -43.68 87.91 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.406 1.082 . . . . 70.01 111.027 -177.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 89.6 t -57.69 -44.31 85.36 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 N-CA-C 109.434 -0.58 . . . . 74.33 109.434 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -69.14 -49.12 59.84 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 123.487 0.715 . . . . 64.25 109.285 -173.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -51.35 -60.41 3.15 Favored 'General case' 0 N--CA 1.44 -0.941 0 C-N-CA 127.154 2.181 . . . . 61.11 108.298 176.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -63.86 -35.48 80.77 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.188 0.518 . . . . 71.23 110.649 -174.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -66.53 -55.78 13.92 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 123.856 0.862 . . . . 71.34 110.891 -179.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.495 ' HE2' HD12 ' A' ' 29' ' ' LEU . 2.0 ttmm -64.29 -29.71 70.79 Favored 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 123.777 0.831 . . . . 71.25 111.997 177.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 36.7 t0 -76.55 33.81 0.14 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.694 1.997 . . . . 65.53 111.299 172.304 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.9 m -140.93 171.57 13.89 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.645 2.378 . . . . 64.34 109.768 177.153 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -119.83 121.12 38.39 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.743 2.017 . . . . 64.45 106.696 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 22.1 mt -112.72 7.77 18.71 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.816 1.647 . . . . 75.05 112.213 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 5.4 t -58.67 -30.93 67.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.674 1.59 . . . . 71.01 111.724 -173.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 63.7 m80 -120.39 41.92 3.11 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 124.296 1.038 . . . . 75.04 109.424 -175.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 28.6 t -129.74 111.05 20.94 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 124.37 1.068 . . . . 74.01 108.477 171.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 21.5 tt0 -57.34 -64.28 0.94 Allowed 'General case' 0 C--O 1.234 0.262 0 C-N-CA 123.52 0.728 . . . . 75.44 109.571 171.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 28.9 m-20 -81.25 89.36 6.04 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.831 0.824 . . . . 74.24 109.988 -171.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.3 mmtm -61.74 -37.01 82.64 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.615 -0.72 . . . . 75.13 111.112 178.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 7.6 p -61.94 -56.28 20.82 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 124.656 1.182 . . . . 64.45 108.715 -179.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.48 ' HA ' ' SG ' ' A' ' 74' ' ' CYS . . . -63.01 -20.7 65.55 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 114.023 1.12 . . . . 40.55 114.023 -174.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -73.98 -56.37 5.03 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 108.641 -0.874 . . . . 64.03 108.641 174.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.664 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.9 OUTLIER -60.68 -48.51 81.48 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 125.077 1.351 . . . . 62.31 109.36 -172.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.48 ' SG ' ' HA ' ' A' ' 71' ' ' ALA . 1.7 p -59.16 -30.58 68.27 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 114.198 -1.365 . . . . 72.24 109.443 -175.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.2 -45.36 71.34 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 125.039 1.304 . . . . 43.51 111.818 174.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.3 t -57.5 -40.79 76.73 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 CA-C-N 118.964 1.382 . . . . 71.41 109.544 176.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.664 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -62.72 -36.18 82.16 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.828 -1.17 . . . . 74.22 110.931 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.0 tttp -62.69 -56.89 13.52 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 109.033 -0.729 . . . . 54.34 109.033 -176.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.94 -51.48 61.26 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.244 -0.884 . . . . 63.14 108.98 176.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.5 m-85 -60.47 -33.84 73.17 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 115.355 1.613 . . . . 75.13 115.355 -173.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.12 -10.22 59.75 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 118.539 0.609 . . . . 75.03 111.22 177.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 73.4 mt-30 -138.12 68.85 1.39 Allowed 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 126.947 2.099 . . . . 42.45 109.333 -175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 29.9 mtp180 -119.99 64.33 0.82 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 125.892 1.677 . . . . 70.32 107.446 174.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.17 -164.38 0.94 Allowed 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 125.428 1.491 . . . . 63.01 108.812 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.07 0 C-N-CA 125.035 1.334 . . . . 73.42 108.468 -173.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.665 0 N-CA-C 111.439 -0.664 . . . . 75.5 111.439 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -80.35 179.38 7.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 122.562 1.172 . . . . 42.11 109.891 168.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -52.35 -31.8 35.29 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 127.612 2.365 . . . . 75.1 113.776 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -66.11 -34.73 78.73 Favored 'General case' 0 CA--C 1.518 -0.28 0 C-N-CA 123.12 0.568 . . . . 64.31 109.87 -172.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -45.12 -54.12 7.18 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 125.879 1.671 . . . . 73.15 111.998 -176.629 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -70.27 -39.69 74.79 Favored 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 112.199 0.444 . . . . 73.23 112.199 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 60.8 m -66.43 -34.42 77.92 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.115 0.566 . . . . 72.21 110.389 178.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 63.9 mt -64.03 -48.22 77.16 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.293 -0.879 . . . . 75.54 110.308 171.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 21.8 mt -60.32 -21.38 61.96 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.928 0.891 . . . . 75.34 112.0 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -81.85 -28.38 33.06 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 123.286 0.634 . . . . 71.52 110.917 177.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -77.28 11.27 1.99 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 125.208 1.403 . . . . 64.34 112.11 -167.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.06 5.36 53.29 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 124.465 1.031 . . . . 71.23 112.48 -177.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.8 mt -97.51 145.44 29.68 Favored Pre-proline 0 CA--C 1.538 0.51 0 CA-C-N 118.267 1.034 . . . . 62.41 111.022 -165.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -68.87 179.58 3.13 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 125.187 3.925 . . . . 72.23 112.72 -177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -71.66 -54.91 8.83 Favored 'General case' 0 C--O 1.233 0.198 0 O-C-N 120.567 -1.333 . . . . 75.43 109.026 172.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 16.4 mmtt -65.39 -31.97 73.35 Favored 'General case' 0 C--O 1.233 0.224 0 N-CA-C 113.369 0.877 . . . . 74.21 113.369 -160.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.4 t -74.68 -54.09 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 N-CA-C 107.738 -1.208 . . . . 72.25 107.738 176.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.17 -35.88 38.34 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.929 1.292 . . . . 51.32 112.033 -177.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.24 -36.14 68.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.098 0.959 . . . . 73.12 112.585 177.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -89.46 -34.96 16.25 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 121.082 -1.011 . . . . 74.23 110.16 172.107 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.546 HD12 HD21 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -73.19 -25.05 60.63 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 124.629 1.171 . . . . 64.52 112.715 -168.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -56.68 -47.6 79.49 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.071 0.948 . . . . 75.51 110.761 175.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.94 -30.45 64.03 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 125.939 1.695 . . . . 64.44 112.144 -174.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.3 mt -64.58 -31.62 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.834 0.853 . . . . 44.34 109.328 -177.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.482 ' HE2' HD23 ' A' ' 21' ' ' LEU . 81.2 m-85 -85.94 -21.73 27.77 Favored 'General case' 0 C--N 1.332 -0.178 0 N-CA-C 112.506 0.558 . . . . 63.52 112.506 177.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 64.1 t -65.91 -50.94 66.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 CA-C-N 118.694 0.679 . . . . 70.22 110.472 -177.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.424 ' HB3' ' CD1' ' A' ' 29' ' ' LEU . . . -75.63 -7.25 53.8 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.628 0.771 . . . . 73.44 112.995 -161.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 80.93 29.66 41.33 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.637 -0.664 . . . . 61.51 112.398 -170.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.478 HD13 ' HE3' ' A' ' 59' ' ' LYS . 1.3 mt -76.34 -44.85 34.81 Favored 'General case' 0 CA--C 1.523 -0.087 0 CA-C-N 117.848 0.824 . . . . 73.12 109.411 173.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.3 m -144.96 149.38 16.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 118.256 0.48 . . . . 73.34 110.953 -177.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -76.39 147.18 38.21 Favored 'General case' 0 C--O 1.233 0.234 0 N-CA-C 108.674 -0.861 . . . . 74.14 108.674 160.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 24.2 p80 -62.66 -43.62 98.34 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.944 -0.472 . . . . 74.43 110.161 171.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.6 m -79.89 19.56 0.68 Allowed 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.085 0.772 . . . . 75.33 113.085 172.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -75.93 -42.47 48.72 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 120.319 1.418 . . . . 75.22 108.758 157.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -62.45 131.56 49.58 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 123.733 0.813 . . . . 71.34 110.054 -171.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.86 170.1 10.37 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.719 1.207 . . . . 74.4 109.712 169.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -56.07 -30.56 62.16 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 125.046 1.338 . . . . 75.31 112.307 -173.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -59.48 -37.36 78.03 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 123.369 0.668 . . . . 63.41 110.928 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.91 -43.82 34.09 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.632 0.773 . . . . 42.41 111.125 178.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 32.8 mm -58.71 -49.06 84.0 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 C-N-CA 123.683 0.793 . . . . 72.54 109.183 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 39.7 tp10 -55.63 -56.7 17.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.154 1.382 . . . . 61.23 109.76 178.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.17 -36.56 75.53 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.724 0.809 . . . . 61.54 111.774 -174.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.6 mt -57.86 -38.01 74.92 Favored 'General case' 0 N--CA 1.453 -0.31 0 N-CA-C 113.007 0.743 . . . . 74.44 113.007 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.94 -32.89 74.82 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 118.566 0.621 . . . . 63.44 111.506 174.31 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -73.73 -15.6 61.21 Favored 'General case' 0 CA--C 1.533 0.302 0 N-CA-C 113.006 0.743 . . . . 63.41 113.006 -171.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -89.18 132.85 34.66 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 119.076 0.853 . . . . 75.32 110.502 -176.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 14.0 p-10 -65.03 175.33 1.59 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 114.263 -1.335 . . . . 73.52 111.749 166.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.4 tt0 -48.32 -64.07 0.9 Allowed 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 126.935 2.094 . . . . 74.52 111.788 -176.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -76.71 -36.69 57.03 Favored 'General case' 0 N--CA 1.461 0.081 0 C-N-CA 122.831 0.452 . . . . 60.25 110.887 -175.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -63.61 -36.33 93.21 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 111.182 -0.767 . . . . 34.23 111.182 -177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.88 -50.78 61.38 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.168 0.987 . . . . 53.02 109.911 174.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 45.4 mt -58.09 -39.02 77.53 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 118.204 0.456 . . . . 75.25 110.286 -177.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.11 -43.42 91.89 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.292 0.637 . . . . 35.23 111.762 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -54.31 -44.35 65.52 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.41 0 N-CA-C 109.42 -0.585 . . . . 75.12 109.42 173.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.546 HD21 HD12 ' A' ' 21' ' ' LEU . 19.9 mt -70.28 -47.05 62.94 Favored 'General case' 0 CA--C 1.509 -0.622 0 N-CA-C 108.339 -0.986 . . . . 72.41 108.339 -169.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -56.58 -56.17 24.68 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 125.46 1.504 . . . . 64.13 110.242 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -62.58 -41.0 98.68 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 122.408 1.099 . . . . 73.1 109.66 -174.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -61.66 -49.68 75.55 Favored 'General case' 0 N--CA 1.446 -0.634 0 C-N-CA 125.184 1.394 . . . . 75.42 110.797 179.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.478 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.6 OUTLIER -71.39 -28.89 64.34 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.965 -1.084 . . . . 72.31 113.415 -179.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -75.73 -1.09 23.25 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.253 0.621 . . . . 72.22 111.463 167.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.2 m -83.77 172.05 12.58 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 120.585 1.539 . . . . 72.0 109.63 168.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -117.48 91.37 3.56 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 124.21 1.004 . . . . 71.33 110.301 -171.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.9 mt -79.99 -2.81 45.69 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 124.081 0.952 . . . . 62.32 113.417 -166.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 34.7 t -47.96 -60.92 2.24 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 126.174 1.79 . . . . 45.4 110.56 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 58.5 m170 -88.05 31.15 0.8 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.294 1.038 . . . . 73.32 111.899 -172.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 55.0 t -123.03 120.75 61.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 106.77 -1.567 . . . . 74.34 106.77 -179.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -73.05 -51.01 19.75 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.874 0.87 . . . . 71.34 109.23 175.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 16.0 p-10 -106.71 80.97 1.51 Allowed 'General case' 0 C--O 1.234 0.247 0 C-N-CA 127.192 2.197 . . . . 72.53 108.195 -160.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -51.76 -37.4 51.15 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 114.262 -1.336 . . . . 74.24 111.251 -176.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 73.9 p -64.08 -56.4 15.22 Favored 'General case' 0 CA--C 1.515 -0.382 0 C-N-CA 124.203 1.001 . . . . 73.24 109.824 -173.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.77 -36.34 72.01 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.33 0.652 . . . . 53.3 111.053 -177.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.26 -53.82 46.94 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 119.69 -0.804 . . . . 71.1 109.499 178.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.59 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -60.47 -53.84 52.69 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 125.338 1.455 . . . . 44.24 109.598 -175.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.424 ' N ' HD13 ' A' ' 73' ' ' LEU . 8.1 t -62.0 -31.64 72.03 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.009 -0.996 . . . . 60.42 110.105 -175.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.0 -49.22 68.31 Favored Glycine 0 CA--C 1.529 0.965 0 CA-C-O 118.932 -0.926 . . . . 62.34 111.411 169.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 60.0 t -59.18 -47.08 91.45 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 CA-C-N 118.517 1.159 . . . . 63.2 109.527 176.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.59 ' CE ' HD11 ' A' ' 73' ' ' LEU . 35.3 mtt -53.41 -47.5 69.53 Favored 'General case' 0 N--CA 1.465 0.283 0 O-C-N 121.69 -0.631 . . . . 74.13 110.53 178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -58.8 -45.48 89.8 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.838 -0.601 . . . . 75.53 110.049 -175.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.22 -47.05 86.79 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.852 0.751 . . . . 62.11 110.556 174.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 -60.3 -42.94 96.58 Favored 'General case' 0 N--CA 1.457 -0.081 0 N-CA-C 113.056 0.762 . . . . 75.42 113.056 -177.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -69.02 -11.01 60.4 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 118.815 0.734 . . . . 72.52 111.339 176.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -134.69 74.33 1.52 Allowed 'General case' 0 N--CA 1.438 -1.049 0 C-N-CA 125.427 1.491 . . . . 73.51 110.107 -175.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 54.8 mtt180 -117.37 90.7 3.39 Favored 'General case' 0 CA--C 1.514 -0.408 0 N-CA-C 108.265 -1.013 . . . . 74.44 108.265 165.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -123.77 156.0 36.87 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.306 1.042 . . . . 62.12 108.298 170.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.7 tmtt? . . . . . 0 C--O 1.25 1.101 0 C-N-CA 125.515 1.526 . . . . 73.34 109.31 -179.484 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.563 0 CA-C-O 121.253 0.363 . . . . 54.31 112.533 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -85.86 -173.95 4.87 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.575 1.95 . . . . 64.13 109.276 163.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 25.1 pm0 -77.33 -26.32 51.98 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 120.733 -1.229 . . . . 55.45 112.918 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 11.7 p30 -58.47 -20.49 45.78 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 119.281 0.946 . . . . 63.12 113.16 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -48.61 -46.89 40.18 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.526 1.131 . . . . 75.24 112.266 -176.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.5 tp60 -65.99 -40.06 90.85 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.876 0.47 . . . . 75.13 111.5 176.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.2 m -59.9 -37.93 80.82 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.986 0.914 . . . . 75.44 110.31 177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 95.8 mt -72.27 -44.16 63.21 Favored 'General case' 0 CA--C 1.52 -0.194 0 C-N-CA 123.947 0.899 . . . . 52.25 111.253 178.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.67 -26.35 44.22 Favored 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 123.787 0.835 . . . . 62.01 111.351 176.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -83.96 -17.79 39.41 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.783 0.833 . . . . 74.43 112.632 -178.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -91.04 19.78 5.44 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.255 1.422 . . . . 73.22 113.72 -161.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 73.95 23.8 75.48 Favored Glycine 0 CA--C 1.525 0.667 0 O-C-N 121.577 -0.702 . . . . 54.43 112.512 -173.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.1 mt -112.06 146.17 34.28 Favored Pre-proline 0 CA--C 1.532 0.26 0 C-N-CA 124.959 1.304 . . . . 71.42 109.173 178.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.2 Cg_endo -74.05 165.84 31.06 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.508 2.139 . . . . 62.13 111.09 177.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -60.17 -41.31 92.6 Favored 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 123.683 0.793 . . . . 73.45 108.891 175.088 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 31.0 mmtm -58.02 -44.69 87.43 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.446 -0.797 . . . . 74.44 111.718 -171.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 85.4 t -70.94 -48.97 53.06 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 107.557 -1.275 . . . . 74.25 107.557 178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.54 67.85 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 113.106 0.78 . . . . 72.25 113.106 -176.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -50.35 -41.04 50.88 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 125.333 1.453 . . . . 75.14 113.893 172.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.52 -24.28 19.69 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 118.507 -0.759 . . . . 74.21 112.165 177.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.3 tp -79.01 -34.52 43.93 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-N 118.962 0.801 . . . . 73.22 111.088 -177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -57.09 -41.35 78.71 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.872 0.844 . . . . 73.05 111.164 175.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.85 -27.71 52.87 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 127.886 2.474 . . . . 74.22 112.446 178.118 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.464 HD13 ' HE3' ' A' ' 59' ' ' LYS . 23.3 mm -71.51 -37.3 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.909 0 N-CA-C 107.726 -1.213 . . . . 71.03 107.726 -177.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -83.03 -10.52 58.7 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.454 1.102 . . . . 75.02 112.471 -176.125 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.3 t -73.77 -42.73 54.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.56 0 O-C-N 121.213 -0.929 . . . . 63.02 109.803 171.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -108.88 37.1 2.64 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.726 0.81 . . . . 53.54 112.152 -144.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.01 18.63 57.74 Favored Glycine 0 CA--C 1.524 0.655 0 C-N-CA 124.954 1.264 . . . . 74.34 115.085 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 19.2 mt -85.12 -65.78 0.97 Allowed 'General case' 0 C--O 1.234 0.253 0 CA-C-N 118.348 1.074 . . . . 71.01 109.165 -178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 13.3 m -139.39 166.54 21.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.823 1.249 . . . . 74.23 110.369 178.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.49 162.93 12.61 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 125.234 1.413 . . . . 51.41 108.558 156.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -58.32 -35.36 71.76 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.847 0.748 . . . . 72.53 110.604 178.226 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 9.1 p -81.69 -5.31 57.99 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 124.537 1.135 . . . . 63.55 112.303 -174.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -82.61 -16.93 46.53 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 118.866 0.757 . . . . 63.41 112.471 -169.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -90.61 -175.24 4.36 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 126.133 1.773 . . . . 71.43 110.55 -176.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -114.02 170.77 8.03 Favored 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.213 1.405 . . . . 72.52 109.828 -177.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -46.57 -44.74 18.29 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.959 1.304 . . . . 72.41 110.608 164.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 69.3 mtt85 -64.49 -22.79 67.07 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 112.774 0.657 . . . . 62.24 112.774 -177.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.28 -52.49 18.59 Favored 'General case' 0 N--CA 1.456 -0.163 0 CA-C-N 119.138 0.881 . . . . 24.53 109.902 171.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 18.8 mm -53.02 -53.81 20.07 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.172 0 C-N-CA 125.144 1.377 . . . . 64.14 109.35 -175.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.3 tp10 -64.02 -44.64 91.97 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 119.613 -0.232 . . . . 74.14 111.372 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.58 -38.52 87.83 Favored 'General case' 0 N--CA 1.456 -0.165 0 N-CA-C 110.178 -0.304 . . . . 75.34 110.178 -176.049 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.7 mt -52.59 -41.63 63.8 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.604 0.762 . . . . 75.12 111.952 173.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.5 mmtm -59.22 -55.13 38.84 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.453 0.57 . . . . 74.42 110.081 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -74.18 -1.19 19.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 116.281 1.956 . . . . 73.31 116.281 -162.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -80.7 159.27 25.32 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.127 0.971 . . . . 74.33 110.309 167.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 22.7 p-10 -75.77 -179.65 4.9 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 124.185 0.994 . . . . 52.32 109.426 159.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -44.77 -70.87 0.09 Allowed 'General case' 0 N--CA 1.437 -1.11 0 C-N-CA 126.978 2.111 . . . . 75.24 110.722 171.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -75.26 -28.97 60.03 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 112.072 0.397 . . . . 75.05 112.072 -166.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.64 -40.44 94.04 Favored Glycine 0 C--N 1.338 0.656 0 N-CA-C 110.416 -1.074 . . . . 62.45 110.416 174.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.75 -49.29 76.99 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 118.48 -0.771 . . . . 75.13 110.374 171.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -56.46 -38.85 72.24 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.589 1.086 . . . . 75.43 111.309 178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.3 -50.45 73.95 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 124.783 1.233 . . . . 71.35 111.069 178.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 63.2 t -52.28 -42.19 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 C-N-CA 123.316 0.647 . . . . 72.25 110.141 175.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -71.49 -45.64 61.95 Favored 'General case' 0 CA--C 1.516 -0.345 0 O-C-N 122.345 -0.222 . . . . 60.33 110.414 -169.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -54.05 -56.86 14.01 Favored 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 124.88 1.272 . . . . 64.01 108.935 173.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -70.56 -6.68 38.26 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 113.099 0.777 . . . . 74.24 113.099 -168.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -93.87 -38.91 10.98 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.027 1.731 . . . . 74.15 111.701 174.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.464 ' HE3' HD13 ' A' ' 24' ' ' ILE . 4.9 mmtt -60.49 -35.27 75.53 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.64 1.109 . . . . 75.25 109.579 165.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -79.46 46.51 0.75 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.904 1.682 . . . . 64.02 109.077 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.2 m -153.76 167.07 30.84 Favored 'General case' 0 N--CA 1.469 0.5 0 O-C-N 120.304 -1.498 . . . . 74.42 111.705 175.079 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -99.78 116.33 31.62 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 126.529 1.932 . . . . 72.41 106.416 175.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 53.8 mt -114.03 8.7 17.16 Favored 'General case' 0 C--N 1.315 -0.926 0 C-N-CA 126.589 1.956 . . . . 53.35 109.92 178.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 6.4 m -75.27 -58.82 3.05 Favored 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 126.978 2.111 . . . . 75.24 108.775 -176.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.0 m80 -78.03 0.67 23.64 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 113.34 0.867 . . . . 75.35 113.34 -178.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 48.9 t -82.7 141.25 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.527 0 O-C-N 120.937 -1.102 . . . . 60.14 109.819 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -69.13 0.54 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.428 1.491 . . . . 35.43 110.282 177.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 12.1 p-10 -111.42 100.93 9.43 Favored 'General case' 0 CA--C 1.516 -0.339 0 C-N-CA 127.34 2.256 . . . . 73.45 107.912 -163.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 11.5 mmtp -60.64 -31.98 71.17 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 124.495 1.118 . . . . 73.12 112.83 -165.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.2 m -57.0 -49.17 76.6 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 125.848 1.659 . . . . 74.15 108.757 177.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.12 -5.63 36.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 113.458 0.91 . . . . 20.33 113.458 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.6 t80 -91.0 -56.33 3.21 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 119.872 -0.731 . . . . 72.41 109.38 163.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.678 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.3 OUTLIER -62.26 -50.8 70.27 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 126.117 1.767 . . . . 52.32 109.674 -165.555 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.7 t -55.09 -36.16 65.36 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.239 -1.346 . . . . 71.23 109.473 -177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.95 -42.04 97.06 Favored Glycine 0 CA--C 1.527 0.839 0 CA-C-O 119.002 -0.888 . . . . 73.14 112.7 177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 47.7 t -60.53 -46.35 95.63 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-N 119.097 1.449 . . . . 54.22 108.653 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.678 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.4 mtt -58.54 -40.44 83.02 Favored 'General case' 0 CA--C 1.53 0.199 0 O-C-N 121.604 -0.685 . . . . 74.15 109.995 176.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -53.75 54.7 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-O 118.485 -0.769 . . . . 61.31 110.963 -175.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -63.05 -42.94 99.84 Favored 'General case' 0 C--O 1.225 -0.231 0 CA-C-O 118.7 -0.667 . . . . 63.25 109.788 177.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.7 m-85 -60.09 -38.04 81.76 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 120.742 1.61 . . . . 75.04 112.523 -179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.74 -21.33 59.41 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.592 0.757 . . . . 72.45 110.242 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -134.44 60.2 1.71 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 126.263 1.825 . . . . 72.35 111.423 -177.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 8.3 ptm180 -104.48 -0.79 27.51 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.797 1.239 . . . . 73.14 112.249 177.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -62.93 108.27 1.17 Allowed 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 107.465 -1.309 . . . . 63.55 107.465 164.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.493 ' HA ' ' HD3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.246 0.885 0 C-N-CA 126.671 1.988 . . . . 73.51 105.705 165.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.794 0 N-CA-C 111.384 -0.686 . . . . 72.0 111.384 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.5 m -96.36 -167.77 1.63 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 124.552 1.141 . . . . 75.42 110.28 166.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -53.07 -33.22 51.07 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 125.773 1.629 . . . . 71.11 113.264 -175.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -60.95 -41.93 97.24 Favored 'General case' 0 C--O 1.227 -0.114 0 C-N-CA 124.797 1.239 . . . . 64.44 110.168 -179.168 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -45.94 -60.93 1.97 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 125.945 1.698 . . . . 75.14 112.754 -170.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 42.9 tp60 -63.38 -33.41 75.47 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 119.223 -0.417 . . . . 41.24 111.494 -175.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.15 -39.61 86.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-O 118.462 -0.78 . . . . 73.23 109.364 177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.42 -44.12 96.07 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 120.011 1.278 . . . . 72.4 109.71 174.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.26 -16.81 61.44 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.996 0.918 . . . . 71.24 112.879 178.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -105.71 -17.79 14.28 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 126.26 1.824 . . . . 64.0 110.767 -178.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.32 30.29 0.71 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 127.507 2.323 . . . . 74.4 110.813 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.455 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 82.38 3.2 90.63 Favored Glycine 0 N--CA 1.441 -0.981 0 CA-C-O 117.784 -1.564 . . . . 71.1 114.277 173.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 34.2 mt -104.29 157.24 34.48 Favored Pre-proline 0 CA--C 1.545 0.787 0 CA-C-N 119.939 1.87 . . . . 42.42 112.92 -172.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -75.67 170.58 19.9 Favored 'Trans proline' 0 CA--C 1.537 0.669 0 C-N-CA 124.346 3.364 . . . . 63.3 113.739 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -66.4 -47.63 72.66 Favored 'General case' 0 CA--C 1.515 -0.397 0 C-N-CA 124.985 1.314 . . . . 55.13 109.728 178.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -42.52 86.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 112.16 0.43 . . . . 72.23 112.16 -166.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -61.93 -57.12 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 126.791 2.036 . . . . 63.11 107.285 173.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.14 -42.69 63.56 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 124.659 1.184 . . . . 73.14 112.491 -172.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -54.11 -45.55 71.9 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.04 0.936 . . . . 74.33 110.217 -178.754 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -80.84 -38.54 28.07 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 119.289 -0.386 . . . . 75.44 110.6 178.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.0 tp -65.33 -41.38 94.0 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 124.736 1.215 . . . . 75.02 110.88 -174.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -55.23 -44.31 75.34 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 124.885 1.274 . . . . 75.31 110.547 -178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.15 -33.36 67.34 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.453 1.101 . . . . 73.44 112.858 179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.6 mt -66.93 -25.25 33.97 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.78 0.832 . . . . 64.33 109.483 -179.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -93.68 -31.84 14.29 Favored 'General case' 0 N--CA 1.454 -0.269 0 C-N-CA 124.08 0.952 . . . . 73.41 111.855 -179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 75.4 t -53.19 -53.47 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 C-N-CA 123.475 0.71 . . . . 74.4 110.883 177.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -77.08 1.75 17.13 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 112.755 0.65 . . . . 63.12 112.755 -177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.08 25.88 72.27 Favored Glycine 0 CA--C 1.528 0.885 0 O-C-N 120.782 -1.199 . . . . 54.54 112.88 174.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.469 HD13 ' HE2' ' A' ' 59' ' ' LYS . 1.8 mp -59.88 -43.88 94.5 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 119.203 1.501 . . . . 75.14 108.067 168.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -132.01 168.63 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.622 0 C-N-CA 126.278 1.831 . . . . 75.24 108.224 167.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -97.97 161.29 13.81 Favored 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 107.862 -1.162 . . . . 73.2 107.862 165.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -59.28 -10.22 2.84 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 115.095 1.517 . . . . 75.23 115.095 -172.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -127.69 42.86 3.24 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.101 1.76 . . . . 63.3 109.73 -179.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 15.2 p-10 -74.47 -10.15 59.28 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 127.793 2.437 . . . . 64.24 113.647 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.3 mt -101.24 158.56 15.95 Favored 'General case' 0 CA--C 1.515 -0.396 0 C-N-CA 122.958 0.503 . . . . 71.34 112.142 -167.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -91.2 163.2 14.34 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 124.999 1.32 . . . . 74.03 109.351 167.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -46.99 -51.94 15.93 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 127.188 2.195 . . . . 71.42 111.784 -178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -76.79 -9.27 58.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.362 -0.828 . . . . 75.34 111.353 -172.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.26 -47.59 41.78 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.197 -1.382 . . . . 73.42 109.387 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.72 -52.09 52.12 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-N 120.597 1.544 . . . . 45.5 109.901 174.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -59.91 -40.44 88.82 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.969 0.729 . . . . 64.0 112.969 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -76.2 -23.24 54.65 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 119.502 1.046 . . . . 72.23 112.67 -179.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.2 mt -66.88 -32.03 73.02 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.16 0.984 . . . . 74.0 110.415 171.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.455 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 1.0 OUTLIER -62.13 -13.18 24.35 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.819 1.247 . . . . 72.0 112.89 174.13 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -104.85 2.99 30.54 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 124.047 0.939 . . . . 65.33 112.852 -171.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 35.4 m-85 -97.47 160.25 14.44 Favored 'General case' 0 C--O 1.234 0.275 0 O-C-N 120.626 -1.297 . . . . 63.24 109.98 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 16.4 p-10 -86.73 178.4 7.03 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.349 1.46 . . . . 73.14 110.107 164.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 21.4 tt0 -52.35 -68.04 0.2 Allowed 'General case' 0 N--CA 1.441 -0.885 0 C-N-CA 127.275 2.23 . . . . 64.23 110.153 179.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -66.02 -34.0 77.08 Favored 'General case' 0 N--CA 1.464 0.226 0 O-C-N 121.92 -0.488 . . . . 75.12 111.781 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.456 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -61.39 -59.5 9.81 Favored Glycine 0 C--N 1.34 0.763 0 N-CA-C 109.616 -1.394 . . . . 52.24 109.616 177.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.86 -45.26 63.99 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.514 0.726 . . . . 71.31 111.891 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -60.63 -37.35 81.17 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 118.903 0.774 . . . . 74.41 111.761 -179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.91 -46.39 74.99 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 118.561 0.619 . . . . 73.11 110.321 174.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.521 HG22 ' CD2' ' A' ' 80' ' ' TYR . 10.2 t -57.62 -40.78 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 CA-C-N 118.608 0.64 . . . . 73.02 110.747 179.443 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.3 mt -61.99 -49.07 77.53 Favored 'General case' 0 CA--C 1.517 -0.317 0 C-N-CA 124.421 1.088 . . . . 75.4 109.824 -177.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -57.53 -52.0 67.2 Favored 'General case' 0 N--CA 1.442 -0.871 0 CA-C-N 115.373 -0.83 . . . . 63.33 109.107 176.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -69.83 -26.21 64.12 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.425 0.557 . . . . 74.34 111.633 -170.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -62.14 -67.66 0.39 Allowed 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.951 -1.129 . . . . 73.0 107.951 168.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.469 ' HE2' HD13 ' A' ' 29' ' ' LEU . 4.4 tppp? -48.8 -37.28 18.74 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 124.192 0.997 . . . . 71.14 111.583 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -72.75 28.14 0.06 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.229 1.411 . . . . 60.13 112.935 -177.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 12.8 m -142.27 157.84 44.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.733 1.613 . . . . 54.54 108.989 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -116.16 79.49 1.32 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 124.364 2.03 . . . . 72.33 108.423 -153.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.406 ' O ' ' HE2' ' A' ' 69' ' ' LYS . 70.0 mt -72.57 -0.2 12.19 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 127.24 2.216 . . . . 74.41 115.187 -165.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.4 t -56.4 -45.6 80.56 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 119.8 1.182 . . . . 74.43 111.368 -163.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 51.7 m170 -106.44 64.08 0.66 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.687 -0.857 . . . . 71.0 108.687 174.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.1 t -131.73 124.92 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.162 0 N-CA-C 106.87 -1.53 . . . . 53.33 106.87 169.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.513 ' H ' ' CD ' ' A' ' 67' ' ' GLN . 0.0 OUTLIER -65.24 -54.27 31.8 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 123.686 0.794 . . . . 72.24 109.134 178.333 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -115.18 71.88 0.78 Allowed 'General case' 0 C--N 1.335 -0.065 0 C-N-CA 125.669 1.587 . . . . 75.32 110.741 -156.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.406 ' HE2' ' O ' ' A' ' 63' ' ' LEU . 30.1 mmtp -46.95 -36.8 8.09 Favored 'General case' 0 N--CA 1.466 0.37 0 C-N-CA 127.02 2.128 . . . . 64.11 112.916 178.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.31 -50.53 67.47 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 125.329 1.452 . . . . 62.04 111.077 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.87 -30.9 71.93 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 122.967 0.507 . . . . 61.04 110.569 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 9.3 t80 -57.29 -54.96 40.89 Favored 'General case' 0 N--CA 1.455 -0.176 0 N-CA-C 108.625 -0.88 . . . . 72.2 108.625 173.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 48.4 tp -59.41 -46.92 87.34 Favored 'General case' 0 CA--C 1.522 -0.114 0 C-N-CA 122.699 0.4 . . . . 75.14 110.532 -178.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 33.1 t -53.55 -41.82 66.85 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.651 0.78 . . . . 54.23 110.856 177.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.58 -53.41 43.84 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.969 -0.853 . . . . 73.42 110.969 176.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.4 t -57.29 -45.38 85.01 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 C-N-CA 123.222 0.609 . . . . 63.32 109.386 177.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 22.3 mtt -55.78 -44.33 77.63 Favored 'General case' 0 N--CA 1.468 0.446 0 O-C-N 120.969 -1.082 . . . . 74.41 111.717 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.4 mptp? -57.16 -53.59 56.41 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 118.792 -0.623 . . . . 71.11 109.453 -178.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 10.8 m -58.68 -43.26 89.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 123.351 0.407 . . . . 55.31 110.848 -178.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.521 ' CD2' HG22 ' A' ' 54' ' ' VAL . 14.4 m-85 -61.92 -38.49 88.61 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 120.959 -1.088 . . . . 74.04 112.463 176.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.72 -11.58 59.84 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 120.711 -1.243 . . . . 74.02 112.438 177.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -144.79 90.63 2.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 124.815 1.246 . . . . 61.23 109.481 -176.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -124.3 50.74 1.65 Allowed 'General case' 0 N--CA 1.463 0.213 0 C-N-CA 124.802 1.241 . . . . 75.11 109.568 -178.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -147.96 178.55 8.42 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.096 2.158 . . . . 73.3 107.609 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 7.6 tptt . . . . . 0 C--O 1.25 1.107 0 C-N-CA 125.631 1.572 . . . . 62.41 109.502 174.681 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.701 0 N-CA-C 109.443 -1.463 . . . . 71.15 109.443 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -107.65 -167.2 1.22 Allowed 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.937 -1.134 . . . . 50.25 107.937 161.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -62.97 -29.48 70.84 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.714 1.606 . . . . 74.31 112.348 179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.46 -36.75 76.56 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 119.105 0.866 . . . . 73.54 110.264 -171.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -44.39 -53.4 6.86 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 126.495 1.918 . . . . 74.25 112.495 -177.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.6 tp60 -61.88 -41.93 98.46 Favored 'General case' 0 N--CA 1.457 -0.117 0 CA-C-O 119.064 -0.493 . . . . 72.25 110.844 -175.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.0 m -67.0 -37.28 83.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 109.539 -0.541 . . . . 64.14 109.539 -178.569 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.99 -36.75 82.44 Favored 'General case' 0 N--CA 1.464 0.259 0 O-C-N 121.281 -0.887 . . . . 63.23 111.295 176.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.69 -23.33 67.22 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.365 0.53 . . . . 64.43 111.084 176.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -87.85 -24.28 23.74 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 118.962 0.801 . . . . 72.24 112.08 174.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -76.38 11.99 1.38 Allowed 'General case' 0 C--O 1.235 0.316 0 C-N-CA 127.101 2.161 . . . . 54.43 112.724 -164.486 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.87 16.12 46.29 Favored Glycine 0 N--CA 1.438 -1.178 0 CA-C-O 117.954 -1.47 . . . . 71.24 114.168 -179.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 27.7 mt -119.79 157.02 53.42 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.773 1.286 . . . . 71.45 113.184 -171.228 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -77.23 172.49 15.95 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 124.657 3.571 . . . . 72.52 113.178 173.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -73.45 -43.72 59.72 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 124.972 1.309 . . . . 74.24 110.278 -178.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.91 -38.48 72.91 Favored 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 120.992 -0.283 . . . . 71.24 111.611 -171.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 67.3 t -70.74 -52.31 29.47 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 C-N-CA 127.227 2.211 . . . . 73.34 107.146 176.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.02 -42.25 62.89 Favored 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 124.889 1.275 . . . . 70.12 112.112 -173.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -52.79 -55.04 25.81 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.209 1.004 . . . . 73.53 110.39 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.55 -27.26 58.58 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 118.568 -0.73 . . . . 74.32 111.308 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 17.3 tp -74.69 -41.63 59.9 Favored 'General case' 0 C--O 1.225 -0.185 0 C-N-CA 124.001 0.92 . . . . 62.33 110.994 -172.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -54.65 -45.97 73.89 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.06 0.944 . . . . 73.53 110.121 177.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.63 -37.57 28.6 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 126.999 2.12 . . . . 63.44 112.403 176.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.3 mt -64.41 -38.04 81.55 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 N-CA-C 108.688 -0.856 . . . . 72.11 108.688 -176.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.426 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 19.7 m-85 -80.98 -4.03 53.67 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.884 1.274 . . . . 74.13 112.74 -179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 42.2 t -85.42 -44.49 17.13 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 119.787 1.176 . . . . 75.55 110.752 175.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.83 -4.29 42.84 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 113.1 0.778 . . . . 72.53 113.1 -162.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.12 -14.84 64.55 Favored Glycine 0 CA--C 1.523 0.552 0 C-N-CA 125.202 1.382 . . . . 62.24 113.179 -176.33 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.427 HD12 ' HE2' ' A' ' 59' ' ' LYS . 87.9 mt -53.47 -51.66 62.02 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 125.681 1.593 . . . . 61.42 110.951 -172.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.413 HG12 ' HB3' ' A' ' 69' ' ' LYS . 5.8 m -136.47 160.09 37.82 Favored 'Isoleucine or valine' 0 C--O 1.234 0.287 0 O-C-N 123.532 0.52 . . . . 63.25 111.899 168.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -84.46 159.68 20.72 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 108.504 -0.924 . . . . 74.43 108.504 156.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.426 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 29.1 p80 -59.97 -31.44 69.9 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 118.934 -0.555 . . . . 61.43 112.088 176.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -94.74 2.05 55.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-O 118.373 -0.823 . . . . 73.12 112.331 179.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -77.34 15.04 0.81 Allowed 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 120.583 1.538 . . . . 54.31 112.694 -177.011 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 51.3 mt -118.09 -170.97 1.98 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 128.43 2.692 . . . . 74.15 106.747 -174.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -132.55 172.63 12.25 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 107.48 -1.304 . . . . 74.41 107.48 178.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -52.76 -36.61 58.22 Favored 'General case' 0 C--O 1.225 -0.228 0 C-N-CA 123.668 0.787 . . . . 63.24 110.825 171.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 45.7 mtt180 -54.63 -32.09 58.37 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.689 -0.632 . . . . 72.51 112.37 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -77.77 -46.01 22.93 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 123.565 0.746 . . . . 61.33 110.963 176.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 27.1 mm -55.23 -53.16 37.9 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.229 0 N-CA-C 107.97 -1.122 . . . . 74.55 107.97 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -61.43 -45.16 95.49 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 125.102 1.361 . . . . 74.51 110.336 -175.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.34 -36.58 84.59 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 118.329 -0.843 . . . . 74.55 111.918 178.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 4.2 mt -59.33 -38.83 81.32 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.239 0.927 . . . . 73.23 111.533 177.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mmtp -61.09 -44.87 96.7 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 118.145 0.429 . . . . 65.25 109.942 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -69.3 11.99 0.2 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 128.921 2.888 . . . . 73.14 116.1 -165.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -118.33 154.27 32.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 124.858 1.263 . . . . 62.14 109.55 -175.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.18 176.9 0.1 Allowed 'General case' 0 N--CA 1.441 -0.909 0 CA-C-O 122.887 1.327 . . . . 63.1 112.141 155.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -52.23 -65.71 0.51 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 127.958 2.503 . . . . 70.22 110.313 165.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.54 -32.97 66.51 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 119.369 0.986 . . . . 50.45 111.973 -174.419 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -50.08 -57.24 10.29 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 124.34 0.971 . . . . 53.25 111.023 168.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.45 -42.87 97.04 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-O 118.659 -0.686 . . . . 74.42 111.297 -178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.86 -50.26 69.51 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 117.733 -1.127 . . . . 71.54 110.728 -179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -53.28 -45.91 69.08 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.632 1.106 . . . . 61.14 111.534 -176.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.41 HG11 ' HG2' ' A' ' 77' ' ' MET . 55.7 t -53.87 -43.12 56.0 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.159 0 C-N-CA 124.507 1.123 . . . . 74.31 111.556 175.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 8.2 mt -72.17 -42.53 65.8 Favored 'General case' 0 CA--C 1.518 -0.286 0 C-N-CA 122.985 0.514 . . . . 71.44 109.994 -175.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 14.7 mt-30 -71.25 -41.09 70.56 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 122.49 0.316 . . . . 75.13 110.834 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -69.31 -17.62 63.74 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 120.404 -0.518 . . . . 62.41 111.157 173.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.477 ' CD2' HD23 ' A' ' 73' ' ' LEU . 16.6 t80 -84.95 -41.45 15.89 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-O 119.418 -0.325 . . . . 70.53 110.324 -179.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.427 ' HE2' HD12 ' A' ' 29' ' ' LEU . 6.6 ttmt -70.91 -19.92 62.54 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.881 0.764 . . . . 75.45 111.362 172.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -75.49 48.23 0.43 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.301 1.44 . . . . 71.34 109.753 168.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.4 m -149.58 152.55 35.67 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.629 -1.919 . . . . 71.52 112.411 176.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -93.37 78.55 4.43 Favored 'General case' 0 C--O 1.234 0.261 0 C-N-CA 125.271 1.428 . . . . 63.43 107.498 179.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 54.5 mt -79.96 -11.86 59.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.181 -0.918 . . . . 74.22 111.064 -168.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 m -53.1 -30.99 39.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.862 2.065 . . . . 75.22 112.07 179.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 62.7 m80 -100.21 14.01 32.31 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 124.352 1.061 . . . . 64.34 113.862 -175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 85.2 t -105.17 135.14 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 O-C-N 121.574 -0.704 . . . . 52.15 109.841 -176.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -62.21 -68.48 0.32 Allowed 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.37 1.868 . . . . 61.25 110.534 176.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -111.61 88.92 2.92 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.34 1.456 . . . . 63.45 109.692 -166.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.413 ' HB3' HG12 ' A' ' 30' ' ' VAL . 38.9 mmtm -53.21 -31.6 43.87 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 125.195 1.398 . . . . 71.44 114.07 -172.746 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.53 25.92 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 128.473 2.709 . . . . 72.15 109.085 -178.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -61.35 -39.12 89.41 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 123.495 0.718 . . . . 73.23 110.146 -175.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -61.97 -51.03 69.71 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 109.33 -0.619 . . . . 63.52 109.33 -179.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.561 HD21 ' HE3' ' A' ' 77' ' ' MET . 0.2 OUTLIER -62.05 -57.57 11.12 Favored 'General case' 0 CA--C 1.516 -0.353 0 C-N-CA 124.473 1.109 . . . . 70.12 108.622 -175.766 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 2.8 t -62.22 -27.1 68.75 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 115.637 -0.71 . . . . 52.43 110.583 -173.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -56.07 -53.69 40.71 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 123.855 0.741 . . . . 72.14 111.405 168.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 40.4 t -54.52 -49.26 67.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 118.285 1.042 . . . . 74.44 108.545 179.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.561 ' HE3' HD21 ' A' ' 73' ' ' LEU . 18.2 mtt -50.59 -54.04 25.82 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 123.617 0.767 . . . . 73.41 110.744 177.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -62.56 -43.99 97.44 Favored 'General case' 0 CA--C 1.516 -0.342 0 N-CA-C 109.802 -0.444 . . . . 74.55 109.802 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -58.6 -47.5 84.12 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.397 0.679 . . . . 70.22 109.607 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -64.06 -44.01 93.74 Favored 'General case' 0 N--CA 1.456 -0.146 0 CA-C-N 118.342 0.519 . . . . 74.53 111.924 -179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 6.5 ttt85 -62.44 -50.74 70.26 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 109.054 -0.721 . . . . 73.34 109.054 -179.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.37 67.88 10.02 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 122.836 1.303 . . . . 72.3 110.011 172.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -105.24 76.11 1.21 Allowed 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 107.949 -1.13 . . . . 74.32 107.949 160.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -122.73 88.16 2.88 Favored 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 102.765 -3.05 . . . . 70.13 102.765 162.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptt . . . . . 0 C--O 1.261 1.693 0 C-N-CA 128.276 2.631 . . . . 74.52 107.47 -169.752 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.88 0 N-CA-C 109.959 -1.256 . . . . 73.53 109.959 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -110.34 -176.61 3.03 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.919 1.288 . . . . 72.12 109.588 -168.117 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -50.99 -37.48 45.13 Favored 'General case' 0 N--CA 1.463 0.179 0 C-N-CA 124.442 1.097 . . . . 74.23 112.459 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -60.95 -35.27 76.3 Favored 'General case' 0 CA--C 1.519 -0.219 0 N-CA-C 108.56 -0.904 . . . . 62.14 108.56 -168.115 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -44.08 -53.39 6.42 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.896 1.678 . . . . 72.53 111.541 176.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.4 tp60 -66.58 -43.5 84.79 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.861 -0.336 . . . . 61.42 110.664 -175.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.5 m -61.65 -38.59 88.28 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.25 0.62 . . . . 73.23 109.882 179.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.1 -37.85 78.63 Favored 'General case' 0 C--O 1.232 0.136 0 C-N-CA 125.656 1.583 . . . . 55.32 111.692 178.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -59.88 -25.49 65.11 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 119.344 0.975 . . . . 64.12 110.135 173.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.89 -11.59 26.47 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.411 1.005 . . . . 73.01 111.905 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -70.47 -2.15 13.03 Favored 'General case' 0 CA--C 1.542 0.64 0 O-C-N 120.829 -1.17 . . . . 74.22 112.184 175.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 106.36 1.89 38.08 Favored Glycine 0 C--N 1.334 0.449 0 C-N-CA 124.49 1.043 . . . . 51.42 113.622 179.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 30.1 mt -100.17 144.84 29.17 Favored Pre-proline 0 N--CA 1.448 -0.563 0 C-N-CA 124.013 0.925 . . . . 74.51 108.688 -160.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.402 ' HG2' HG23 ' A' ' 17' ' ' VAL . 73.9 Cg_endo -69.61 164.23 35.16 Favored 'Trans proline' 0 N--CA 1.45 -1.07 0 C-N-CA 121.639 1.559 . . . . 71.24 110.496 176.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -62.46 -46.81 86.8 Favored 'General case' 0 N--CA 1.446 -0.657 0 N-CA-C 108.28 -1.007 . . . . 74.2 108.28 -178.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.02 -36.91 71.0 Favored 'General case' 0 N--CA 1.442 -0.86 0 N-CA-C 114.219 1.192 . . . . 75.34 114.219 -174.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . 0.402 HG23 ' HG2' ' A' ' 14' ' ' PRO . 57.4 t -73.96 -52.47 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.379 0 N-CA-C 107.049 -1.463 . . . . 72.2 107.049 174.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.2 -36.09 51.02 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 124.381 1.073 . . . . 52.21 112.589 -174.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -51.62 -56.18 15.05 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.531 0.733 . . . . 62.2 110.738 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -76.81 -32.88 57.93 Favored 'General case' 0 N--CA 1.457 -0.116 0 CA-C-N 115.839 -0.618 . . . . 71.33 110.389 -177.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.54 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.5 OUTLIER -71.58 -32.25 67.85 Favored 'General case' 0 C--O 1.224 -0.268 0 C-N-CA 124.451 1.1 . . . . 62.55 111.185 -174.401 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -57.59 -45.17 85.61 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 125.006 1.322 . . . . 75.44 111.567 173.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.84 -27.45 66.66 Favored 'General case' 0 C--N 1.333 -0.152 0 C-N-CA 124.473 1.109 . . . . 75.41 112.975 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 64.7 mt -67.77 -17.23 22.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.66 -0.65 . . . . 75.54 109.509 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.54 ' HE2' HD23 ' A' ' 21' ' ' LEU . 64.7 m-85 -97.99 -0.96 43.75 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.644 1.178 . . . . 75.32 113.227 175.38 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.0 t -84.1 -55.6 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.191 -0.943 . . . . 75.23 109.078 175.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -95.06 36.42 1.21 Allowed 'General case' 0 C--O 1.232 0.182 0 C-N-CA 125.513 1.525 . . . . 61.12 111.469 -151.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 59.28 27.95 63.7 Favored Glycine 0 CA--C 1.532 1.115 0 C-N-CA 125.378 1.466 . . . . 63.12 115.156 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.437 ' CD1' ' HE2' ' A' ' 59' ' ' LYS . 38.5 mt -85.44 -66.02 0.95 Allowed 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 123.789 0.836 . . . . 74.54 109.207 176.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 3.4 m -136.99 161.73 35.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 123.078 0.551 . . . . 60.41 110.789 177.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -94.25 158.6 15.51 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 127.644 2.378 . . . . 60.14 109.588 158.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -58.17 -31.94 67.73 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 118.204 0.456 . . . . 75.23 111.911 -179.037 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 2.4 t -95.21 10.32 36.44 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 123.563 0.745 . . . . 63.23 111.959 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -83.03 -12.12 57.49 Favored 'General case' 0 N--CA 1.471 0.593 0 O-C-N 120.679 -1.263 . . . . 74.42 111.193 169.261 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.98 179.4 5.97 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.964 2.106 . . . . 51.22 109.91 174.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 p30 -139.34 -175.92 4.35 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 124.526 1.13 . . . . 62.13 110.373 176.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 88.5 tt0 -55.73 -36.48 67.3 Favored 'General case' 0 N--CA 1.466 0.359 0 O-C-N 121.388 -0.82 . . . . 75.02 111.642 -177.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 35.0 mtm-85 -66.73 -18.71 65.51 Favored 'General case' 0 C--N 1.338 0.076 0 CA-C-O 118.859 -0.591 . . . . 75.15 111.294 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.72 -51.92 11.64 Favored 'General case' 0 N--CA 1.453 -0.282 0 CA-C-N 119.491 1.042 . . . . 53.12 109.93 169.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 28.4 mm -60.8 -50.44 80.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 125.225 1.41 . . . . 75.13 110.372 -173.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.22 -44.07 76.55 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 109.626 -0.509 . . . . 74.24 109.626 -174.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.71 -35.88 82.04 Favored 'General case' 0 C--N 1.343 0.317 0 C-N-CA 122.761 0.424 . . . . 64.2 111.748 177.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.9 mt -56.42 -45.86 80.5 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 118.466 0.575 . . . . 71.45 111.259 178.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -20.61 66.14 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.098 -0.953 . . . . 73.12 111.733 177.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.432 ' CD ' HH21 ' A' ' 81' ' ' ARG . 2.1 mt-10 -85.42 43.7 1.04 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 120.423 1.465 . . . . 71.41 111.876 177.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 63.4 m-85 -139.79 156.32 46.82 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.961 -1.087 . . . . 73.2 110.053 170.081 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 13.7 p-10 -84.99 178.13 7.69 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 123.547 0.739 . . . . 71.44 109.947 165.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.7 tt0 -49.41 -56.39 9.81 Favored 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 126.088 1.755 . . . . 71.41 112.04 -179.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.1 t70 -81.41 -34.1 31.78 Favored 'General case' 0 CA--C 1.528 0.109 0 O-C-N 122.028 -0.42 . . . . 71.42 111.625 -172.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -68.48 -39.48 87.07 Favored Glycine 0 C--N 1.339 0.739 0 N-CA-C 111.544 -0.622 . . . . 71.21 111.544 179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -54.73 -49.96 69.53 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 124.947 1.299 . . . . 73.54 109.567 168.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 36.8 mt -63.52 -35.27 79.93 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 118.061 -0.971 . . . . 75.11 111.502 -178.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.57 -46.38 87.03 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.527 1.058 . . . . 35.51 110.853 175.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -54.66 -41.64 56.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.463 0 O-C-N 121.618 -0.677 . . . . 64.44 110.444 173.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.7 mt -78.27 -33.19 49.74 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.403 -0.811 . . . . 75.31 110.45 -172.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -54.89 -62.5 1.61 Allowed 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 107.228 -1.397 . . . . 75.34 107.228 167.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -72.97 -10.06 59.4 Favored 'General case' 0 CA--C 1.537 0.473 0 N-CA-C 113.471 0.915 . . . . 74.42 113.471 -164.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -84.18 -61.31 1.84 Allowed 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 123.867 0.867 . . . . 60.32 110.535 172.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HE2' ' CD1' ' A' ' 29' ' ' LEU . 13.4 ttmt -63.79 -30.1 71.23 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 119.519 1.054 . . . . 74.23 110.573 179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 35.3 t0 -81.88 57.51 3.48 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 124.381 1.073 . . . . 75.31 109.959 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 75.7 m -153.8 177.31 11.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 127.055 2.142 . . . . 73.43 107.78 161.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -115.75 105.72 13.05 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.827 2.051 . . . . 74.54 106.614 -171.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.2 mt -94.59 7.25 46.31 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 124.049 0.939 . . . . 71.35 111.985 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 13.2 m -53.83 126.47 22.3 Favored 'General case' 0 N--CA 1.451 -0.401 0 N-CA-C 108.901 -0.777 . . . . 52.05 108.901 165.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 18.5 m80 59.39 10.26 1.75 Allowed 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.447 1.899 . . . . 72.51 114.869 174.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 44.6 t -70.26 135.79 27.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.235 0 N-CA-C 107.357 -1.349 . . . . 72.04 107.357 170.086 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -54.17 -85.0 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.214 1.806 . . . . 53.42 111.479 178.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -119.49 99.96 7.0 Favored 'General case' 0 CA--C 1.515 -0.382 0 N-CA-C 106.738 -1.578 . . . . 71.23 106.738 -162.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 38.1 mmtm -62.89 -28.62 70.17 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 124.586 1.154 . . . . 74.05 111.232 -169.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.15 -51.38 66.64 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 126.304 1.842 . . . . 52.53 109.26 174.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -74.01 -24.41 59.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.736 -0.649 . . . . 73.42 112.085 -175.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -67.07 -56.55 9.57 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 107.053 -1.462 . . . . 64.03 107.053 171.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.689 HD11 ' HE2' ' A' ' 77' ' ' MET . 0.9 OUTLIER -55.73 -52.54 63.56 Favored 'General case' 0 CA--C 1.517 -0.304 0 C-N-CA 125.717 1.607 . . . . 64.44 110.118 -173.908 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 49.5 t -61.96 -28.03 69.26 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-N 115.559 -0.746 . . . . 61.04 110.216 -177.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -61.67 -47.3 91.24 Favored Glycine 0 CA--C 1.528 0.861 0 O-C-N 121.415 -0.803 . . . . 62.13 111.397 173.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 8.0 t -54.55 -53.68 29.08 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 C-N-CA 123.944 0.898 . . . . 63.35 109.023 177.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.689 ' HE2' HD11 ' A' ' 73' ' ' LEU . 2.2 mtt -56.2 -50.1 72.18 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.015 0.526 . . . . 75.04 110.97 -178.248 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 58.2 mttt -54.22 -51.0 65.85 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.649 -0.5 . . . . 75.01 109.649 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.3 m -54.59 -48.5 72.08 Favored 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 124.514 1.134 . . . . 72.43 109.897 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -64.21 -44.11 92.92 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 119.183 0.901 . . . . 75.23 112.55 -179.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.432 HH21 ' CD ' ' A' ' 45' ' ' GLU . 3.9 ttt-85 -70.79 -19.42 62.69 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 119.186 0.903 . . . . 75.21 111.457 178.511 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -129.96 65.68 1.5 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 122.823 1.297 . . . . 73.11 108.944 -179.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 21.7 ptt85 -99.25 5.24 46.72 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 114.51 -1.223 . . . . 75.41 112.447 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 25.9 pt-20 -83.15 30.59 0.45 Allowed 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.481 1.513 . . . . 74.44 112.55 176.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.42 ' HD3' ' HA ' ' A' ' 85' ' ' LYS . 6.6 tppt? . . . . . 0 C--O 1.246 0.913 0 C-N-CA 126.686 1.995 . . . . 64.21 107.637 -166.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.449 0 N-CA-C 110.595 -1.002 . . . . 61.54 110.595 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -137.11 -167.87 2.18 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 109.544 -0.539 . . . . 63.53 109.544 -173.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.04 23.52 0.08 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 120.606 -1.309 . . . . 50.43 114.32 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -103.7 -32.97 9.11 Favored 'General case' 0 C--N 1.324 -0.522 0 C-N-CA 127.23 2.212 . . . . 72.45 110.457 175.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -54.43 -59.38 4.77 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.516 1.127 . . . . 74.24 112.456 -172.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 63.6 tp60 -59.42 -28.8 67.26 Favored 'General case' 0 CA--C 1.529 0.158 0 C-N-CA 124.419 1.088 . . . . 74.21 111.754 -174.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -59.54 -40.52 87.51 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 124.0 0.92 . . . . 62.45 109.509 178.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -66.91 -39.38 87.38 Favored 'General case' 0 C--N 1.342 0.27 0 O-C-N 121.672 -0.642 . . . . 64.13 110.97 177.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 15' ' ' GLN . 3.4 mm? -64.41 -20.83 66.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 118.666 -0.683 . . . . 72.33 110.373 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -95.55 -6.02 41.36 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.508 1.123 . . . . 71.43 110.814 176.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.78 15.27 5.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 119.3 -2.125 . . . . 71.35 112.306 -175.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 88.94 11.84 64.68 Favored Glycine 0 CA--C 1.526 0.772 0 O-C-N 121.029 -1.044 . . . . 63.53 113.547 -176.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.417 HD11 HD13 ' A' ' 43' ' ' LEU . 61.6 mt -116.06 160.7 34.44 Favored Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 118.861 1.331 . . . . 63.41 113.507 -161.716 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -71.14 172.97 12.9 Favored 'Trans proline' 0 C--N 1.349 0.566 0 C-N-CA 123.463 2.775 . . . . 61.05 111.557 172.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.428 ' HA ' HD11 ' A' ' 9' ' ' LEU . 7.9 tt0 -70.54 -48.0 57.56 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 118.402 -0.809 . . . . 74.21 110.349 169.574 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 34.5 mmtt -53.91 -36.1 62.37 Favored 'General case' 0 N--CA 1.465 0.317 0 N-CA-C 113.271 0.841 . . . . 70.02 113.271 -163.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 87.7 t -70.67 -55.39 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 C-N-CA 127.889 2.475 . . . . 74.03 107.978 177.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -47.12 -41.09 16.83 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.83 1.252 . . . . 64.41 112.162 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 57.8 mt-10 -61.63 -21.52 64.45 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 114.957 1.466 . . . . 74.44 114.957 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.93 -21.23 11.24 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.568 0.543 . . . . 61.25 112.343 170.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.5 tp -69.97 -28.11 65.27 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.214 1.006 . . . . 74.22 111.449 176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.1 t0 -52.08 -45.83 64.94 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 125.292 1.437 . . . . 70.15 111.7 177.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -65.1 -27.98 69.13 Favored 'General case' 0 N--CA 1.445 -0.694 0 C-N-CA 127.288 2.235 . . . . 74.35 114.124 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.597 HG22 HG22 ' A' ' 30' ' ' VAL . 17.1 mm -57.48 -32.94 43.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.699 0 N-CA-C 109.144 -0.687 . . . . 70.14 109.144 176.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.428 ' CE1' HG23 ' A' ' 30' ' ' VAL . 68.1 m-85 -82.42 -49.92 9.44 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.4 1.08 . . . . 71.51 110.088 177.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 47.6 t -51.74 -41.83 30.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.548 0 C-N-CA 123.495 0.718 . . . . 63.13 112.195 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -75.2 7.82 3.12 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.694 1.198 . . . . 71.12 112.113 -171.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.74 -2.27 59.73 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 124.119 0.866 . . . . 44.2 113.036 176.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.424 HD12 ' HE2' ' A' ' 59' ' ' LYS . 59.6 mt -66.61 -52.11 48.84 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 124.136 0.974 . . . . 70.31 109.353 -172.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.597 HG22 HG22 ' A' ' 24' ' ' ILE . 30.7 m -132.64 162.84 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 113.721 1.008 . . . . 73.11 113.721 179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -99.64 155.68 17.48 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 125.412 1.485 . . . . 63.3 109.271 167.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 19.9 p80 -70.34 -12.55 61.66 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.466 0.913 . . . . 64.41 113.466 -172.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 47.3 m -118.63 18.4 13.46 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.576 1.15 . . . . 45.02 111.916 172.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -68.84 -30.09 68.55 Favored 'General case' 0 N--CA 1.469 0.484 0 O-C-N 121.311 -0.868 . . . . 71.13 110.228 169.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -77.07 127.29 32.41 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 125.067 1.347 . . . . 73.21 108.902 -175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -83.53 164.08 20.03 Favored 'General case' 0 C--N 1.332 -0.181 0 N-CA-C 107.431 -1.322 . . . . 70.4 107.431 178.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -44.6 -44.2 8.71 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 127.067 2.147 . . . . 65.0 113.263 179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 -51.07 -38.18 50.07 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 124.876 1.27 . . . . 73.1 113.368 176.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -84.28 -28.1 27.4 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 124.111 0.965 . . . . 73.32 111.604 179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 17.0 mm -67.6 -45.24 85.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.427 0 N-CA-C 109.493 -0.558 . . . . 51.14 109.493 176.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 53.4 tp10 -57.92 -49.09 77.93 Favored 'General case' 0 CA--C 1.528 0.123 0 N-CA-C 109.398 -0.593 . . . . 63.34 109.398 172.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.4 -37.28 77.59 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-O 118.756 -0.64 . . . . 73.01 111.419 -178.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 43' ' ' LEU . 4.9 mt -56.64 -51.54 68.31 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-N 120.197 1.362 . . . . 74.4 112.688 173.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -58.06 -17.12 15.73 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 113.565 0.95 . . . . 74.11 113.565 177.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -77.64 -20.63 53.49 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 120.517 1.508 . . . . 72.3 114.819 -170.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -94.95 160.93 14.36 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 122.168 0.985 . . . . 62.43 110.979 -168.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -85.09 178.86 7.4 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.915 1.286 . . . . 73.24 110.794 166.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.57 -36.54 66.97 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 125.72 1.608 . . . . 65.22 113.628 -172.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -98.13 -34.34 10.79 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 125.269 1.427 . . . . 74.13 109.929 -178.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -59.31 -43.49 97.25 Favored Glycine 0 CA--C 1.528 0.884 0 N-CA-C 111.016 -0.834 . . . . 50.54 111.016 178.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.55 -48.26 81.8 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.874 1.27 . . . . 63.3 109.783 173.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.8 mp -61.96 -30.82 71.18 Favored 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 123.939 0.895 . . . . 74.34 111.727 -177.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.47 -42.75 82.48 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 119.312 0.96 . . . . 50.2 111.654 173.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 96.6 t -55.07 -41.06 57.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 N-CA-C 109.134 -0.691 . . . . 64.42 109.134 174.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 52.8 mt -70.55 -51.29 29.56 Favored 'General case' 0 CA--C 1.52 -0.196 0 CA-C-O 118.78 -0.629 . . . . 72.01 110.42 -178.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -63.62 -20.72 65.9 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.038 0.535 . . . . 74.44 112.41 -174.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -87.68 -40.01 14.52 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.636 0.375 . . . . 64.23 110.937 171.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . 0.43 ' CZ ' ' HB2' ' A' ' 73' ' ' LEU . 61.4 t80 -77.16 -36.1 55.43 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.554 0.946 . . . . 74.13 113.554 -173.173 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.424 ' HE2' HD12 ' A' ' 29' ' ' LEU . 0.1 OUTLIER -58.18 -37.77 75.39 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.711 -1.243 . . . . 71.24 109.218 169.422 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -83.44 2.22 37.74 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 127.123 2.169 . . . . 71.1 112.112 -173.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.5 m -82.61 152.29 25.97 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.622 1.201 . . . . 65.22 111.914 174.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 -83.29 53.81 2.6 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 127.439 2.296 . . . . 73.42 109.19 -175.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.44 -0.49 12.68 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 114.843 1.423 . . . . 74.12 114.843 -163.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 11.4 m -58.06 -59.71 4.85 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 119.842 1.201 . . . . 62.3 110.479 178.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -84.8 53.08 2.59 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.385 1.074 . . . . 65.31 110.389 177.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 94.4 t -133.23 121.06 41.9 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 106.709 -1.589 . . . . 62.03 106.709 170.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -78.45 -56.54 4.36 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 119.29 0.95 . . . . 73.43 109.612 169.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -77.05 72.82 3.62 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 125.02 1.328 . . . . 71.1 110.705 -172.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 55.4 mmtt -57.79 -39.02 76.54 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.994 -0.441 . . . . 73.2 112.052 -176.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -64.87 -52.72 55.08 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 127.839 2.456 . . . . 70.22 108.457 -172.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.09 -37.29 79.49 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.907 -0.588 . . . . 74.34 110.843 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -62.61 -50.37 71.52 Favored 'General case' 0 CA--C 1.53 0.173 0 N-CA-C 109.339 -0.615 . . . . 74.43 109.339 178.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.648 HD11 ' CE ' ' A' ' 77' ' ' MET . 1.3 tm? -59.52 -52.06 67.18 Favored 'General case' 0 CA--C 1.517 -0.301 0 C-N-CA 123.938 0.895 . . . . 65.24 109.819 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.8 t -58.36 -37.93 76.19 Favored 'General case' 0 CA--C 1.543 0.681 0 CA-C-N 115.306 -0.861 . . . . 72.11 109.502 -177.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -59.03 -45.04 95.82 Favored Glycine 0 CA--C 1.534 1.25 0 C-N-CA 124.557 1.075 . . . . 42.2 113.167 171.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 59.2 t -59.47 -39.51 79.39 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-N 119.332 1.566 . . . . 71.41 109.587 174.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.648 ' CE ' HD11 ' A' ' 73' ' ' LEU . 1.6 mtt -62.72 -35.42 79.7 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 120.287 -1.508 . . . . 71.42 111.285 176.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.411 ' HE3' ' HB3' ' A' ' 78' ' ' LYS . 15.3 mtpp -62.93 -46.01 89.81 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-O 118.461 -0.78 . . . . 65.34 111.398 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.6 t -62.14 -47.85 82.72 Favored 'General case' 0 C--O 1.224 -0.28 0 CA-C-N 119.667 1.121 . . . . 71.32 108.414 175.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -63.81 -32.66 74.24 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 115.093 1.516 . . . . 73.13 115.093 -170.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 15.0 mtp180 -77.94 -29.55 50.02 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 119.969 1.259 . . . . 74.32 112.308 169.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -129.32 82.35 2.07 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 124.519 1.128 . . . . 74.33 109.122 -171.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 48.2 ptt85 -131.1 26.67 4.89 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 126.763 2.025 . . . . 72.13 110.137 -177.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 29.6 mt-10 -144.09 178.53 7.81 Favored 'General case' 0 C--O 1.242 0.686 0 C-N-CA 125.316 1.446 . . . . 65.2 109.847 -175.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 48.4 mmtt . . . . . 0 C--O 1.254 1.312 0 CA-C-O 117.111 -1.423 . . . . 70.1 110.875 161.789 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.461 0.352 0 N-CA-C 108.576 -1.81 . . . . 61.03 108.576 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 m -97.89 -170.39 1.98 Allowed 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 123.696 0.798 . . . . 62.02 110.429 -177.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -61.53 -10.14 7.34 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 114.597 1.332 . . . . 63.5 114.597 -175.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -70.69 -43.21 69.51 Favored 'General case' 0 C--O 1.223 -0.293 0 CA-C-N 120.305 1.412 . . . . 74.4 108.679 173.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -47.02 -56.84 5.74 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.65 1.58 . . . . 73.21 112.622 -173.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.1 tp60 -59.99 -42.66 94.68 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 122.506 0.323 . . . . 73.32 110.958 -179.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.3 m -69.83 -36.88 75.96 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 119.03 -0.51 . . . . 74.31 109.734 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.89 -39.42 91.89 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 119.744 1.156 . . . . 71.32 111.493 175.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.515 HD21 ' HA ' ' A' ' 15' ' ' GLN . 22.1 mt -63.29 -27.47 69.36 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.104 0.561 . . . . 73.11 111.131 176.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -90.94 -29.83 17.22 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 123.325 0.65 . . . . 75.12 110.965 177.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.68 -15.6 41.53 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 127.029 2.132 . . . . 60.23 111.661 177.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.429 ' HA3' ' HE2' ' A' ' 44' ' ' LYS . . . 127.04 4.93 5.86 Favored Glycine 0 C--N 1.336 0.536 0 CA-C-O 117.411 -1.772 . . . . 74.43 114.936 167.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 58.9 mt -98.78 153.87 37.68 Favored Pre-proline 0 C--O 1.235 0.306 0 CA-C-N 118.795 1.297 . . . . 73.14 111.387 -169.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -69.48 165.91 29.03 Favored 'Trans proline' 0 N--CA 1.457 -0.656 0 C-N-CA 122.932 2.421 . . . . 64.04 111.288 171.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.515 ' HA ' HD21 ' A' ' 9' ' ' LEU . 25.9 tt0 -61.73 -40.37 94.85 Favored 'General case' 0 CA--C 1.511 -0.546 0 C-N-CA 124.463 1.105 . . . . 64.14 109.981 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mptp? -59.01 -51.29 70.71 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 123.913 0.758 . . . . 61.24 110.2 -172.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 69.9 t -62.5 -50.71 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.551 0 C-N-CA 124.904 1.282 . . . . 53.1 107.789 179.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.37 -41.45 76.24 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.574 0.624 . . . . 74.03 112.373 -176.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -57.53 -40.19 78.26 Favored 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 124.245 1.018 . . . . 71.41 110.865 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -80.89 -35.49 32.49 Favored 'General case' 0 C--O 1.231 0.089 0 O-C-N 121.828 -0.545 . . . . 42.42 110.03 -178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 48.8 tp -77.52 -36.96 51.92 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.926 -0.559 . . . . 74.4 112.313 -170.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -54.27 -40.9 68.25 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.773 0.715 . . . . 64.12 111.313 -172.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -58.38 -33.72 69.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 128.32 2.648 . . . . 70.23 111.856 179.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 37.7 mm -58.78 -40.13 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 C-N-CA 125.039 1.336 . . . . 65.34 109.728 178.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -79.64 -47.07 16.02 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.166 0.586 . . . . 73.41 109.98 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 93.1 t -53.68 -46.15 61.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 C-N-CA 123.678 0.791 . . . . 72.33 111.174 -178.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.74 -1.18 13.0 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 113.348 0.87 . . . . 73.12 113.348 -176.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 78.07 32.23 44.99 Favored Glycine 0 N--CA 1.446 -0.646 0 C-N-CA 124.292 0.948 . . . . 21.41 112.355 171.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.59 -85.2 0.07 Allowed 'General case' 0 C--O 1.233 0.194 0 N-CA-C 106.826 -1.546 . . . . 72.01 106.826 170.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -103.2 175.92 0.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 124.441 1.096 . . . . 71.24 110.194 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.86 158.47 15.95 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.664 0.785 . . . . 63.31 111.447 176.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 10.3 p80 -64.43 -9.1 16.14 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.464 1.105 . . . . 61.53 113.857 179.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.1 t -124.06 8.79 8.64 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.213 1.805 . . . . 64.0 110.149 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.9 -15.71 63.12 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 113.515 0.932 . . . . 74.03 113.515 -167.25 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -101.55 151.0 22.49 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 123.901 0.88 . . . . 63.12 111.75 -159.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -81.95 159.3 23.62 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 107.246 -1.39 . . . . 35.35 107.246 178.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -62.13 -28.85 69.93 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.702 -0.624 . . . . 60.11 112.515 -174.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 7.9 mtp180 -68.64 -30.47 69.19 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 121.367 -0.833 . . . . 74.43 112.261 175.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.33 -30.05 60.18 Favored 'General case' 0 N--CA 1.448 -0.555 0 N-CA-C 109.969 -0.382 . . . . 74.24 109.969 178.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 13.8 mm -64.99 -53.02 46.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 109.097 -0.705 . . . . 73.1 109.097 170.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -62.27 -47.38 84.61 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.237 1.015 . . . . 75.15 111.062 -173.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.41 -29.13 69.21 Favored 'General case' 0 N--CA 1.455 -0.192 0 O-C-N 122.05 -0.406 . . . . 75.23 111.7 -175.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 1.7 mt -56.95 -44.85 82.95 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 118.597 0.635 . . . . 63.43 111.816 171.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.429 ' HE2' ' HA3' ' A' ' 12' ' ' GLY . 0.4 OUTLIER -54.46 -20.13 7.01 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.566 1.146 . . . . 72.44 113.509 173.668 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -79.8 -14.45 58.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 120.363 1.438 . . . . 73.44 112.508 -175.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -88.9 168.28 12.53 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 125.739 1.616 . . . . 64.01 109.557 177.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -96.1 -172.84 2.65 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 126.293 1.837 . . . . 65.01 109.952 165.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.87 -67.56 0.24 Allowed 'General case' 0 N--CA 1.441 -0.914 0 C-N-CA 127.313 2.245 . . . . 63.24 111.386 174.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -61.84 -36.76 82.14 Favored 'General case' 0 N--CA 1.465 0.275 0 C-N-CA 123.198 0.599 . . . . 72.03 110.811 -176.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.567 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -50.46 -74.7 0.26 Allowed Glycine 0 C--N 1.338 0.673 0 C-N-CA 124.98 1.276 . . . . 62.43 110.517 172.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.24 -44.02 92.36 Favored 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.802 1.241 . . . . 70.24 111.938 -174.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 26.4 tp -61.05 -37.25 81.97 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.099 0.959 . . . . 71.13 110.209 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.27 -45.25 81.13 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.83 0.741 . . . . 64.33 111.175 171.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 50' ' ' GLY . 3.2 t -59.02 -23.31 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.898 0 CA-C-N 118.791 0.723 . . . . 73.25 111.089 178.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -74.81 -46.5 36.36 Favored 'General case' 0 C--N 1.341 0.203 0 O-C-N 120.392 -1.442 . . . . 63.34 110.298 174.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.28 -34.48 60.96 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 123.911 0.884 . . . . 74.12 111.549 -174.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.97 -25.97 24.04 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.746 0.308 . . . . 70.15 111.748 -177.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -66.54 -30.3 70.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.836 0.854 . . . . 73.21 112.295 179.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -78.03 -25.65 47.97 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.098 -1.001 . . . . 70.42 111.524 167.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.18 45.22 0.73 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.904 1.282 . . . . 45.34 111.437 -177.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 14.5 m -160.84 178.63 9.23 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.597 1.559 . . . . 71.23 110.663 174.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.8 66.72 1.34 Allowed 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 129.69 3.196 . . . . 53.52 106.579 -146.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mt -70.18 7.22 1.04 Allowed 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.31 1.844 . . . . 74.33 112.861 -167.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 31.6 t -68.63 -6.17 24.27 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 128.348 2.659 . . . . 62.3 111.58 178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 28.8 m170 -131.32 38.11 3.65 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.276 1.03 . . . . 71.42 109.984 169.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 p -127.56 123.21 60.97 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.585 0 CA-C-O 121.511 0.672 . . . . 61.4 110.042 166.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -80.27 -60.96 2.13 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 115.141 -0.936 . . . . 74.21 108.906 168.623 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -80.21 102.94 9.75 Favored 'General case' 0 N--CA 1.453 -0.323 0 N-CA-C 108.975 -0.75 . . . . 62.31 108.975 -171.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 59.7 mmtt -73.89 -28.85 61.76 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.328 -0.851 . . . . 74.41 111.142 -175.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 4.5 m -66.36 -55.82 14.04 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 124.172 0.989 . . . . 74.4 110.503 -173.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.99 -35.73 77.59 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 124.726 1.21 . . . . 64.01 110.17 -178.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 t80 -63.89 -48.35 76.99 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-O 121.204 0.526 . . . . 75.33 110.611 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 33.3 tp -61.04 -48.94 79.44 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.63 0.772 . . . . 73.04 110.213 -177.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 3.6 m -55.12 -34.71 63.95 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.285 1.434 . . . . 74.02 112.307 170.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -60.46 -48.33 86.71 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 124.145 0.879 . . . . 45.41 111.064 176.804 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 19.6 t -61.48 -43.93 97.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 CA-C-N 117.548 0.674 . . . . 71.21 109.324 176.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 31.2 mtt -53.76 -45.51 70.64 Favored 'General case' 0 N--CA 1.467 0.376 0 O-C-N 121.095 -1.003 . . . . 72.15 110.19 175.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 11.7 tttt -67.66 -29.51 68.82 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 118.035 -0.983 . . . . 64.11 112.722 -168.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 15.1 t -72.8 -49.36 31.07 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.351 1.432 . . . . 54.53 108.514 169.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -61.38 -33.53 73.83 Favored 'General case' 0 CA--C 1.54 0.563 0 O-C-N 120.846 -1.159 . . . . 72.22 113.774 -175.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.89 -7.16 59.58 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.341 1.056 . . . . 64.43 112.368 178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -137.33 75.25 1.52 Allowed 'General case' 0 C--O 1.239 0.533 0 C-N-CA 125.458 1.503 . . . . 72.35 109.303 177.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 10.9 mtp180 -111.8 89.08 2.96 Favored 'General case' 0 CA--C 1.519 -0.227 0 N-CA-C 106.025 -1.843 . . . . 64.23 106.025 165.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 84.2 mt-10 -87.37 86.03 7.21 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 104.011 -2.589 . . . . 45.55 104.011 164.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.519 ' HE3' ' HA ' ' A' ' 85' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.129 0 N-CA-C 105.327 -2.101 . . . . 62.25 105.327 -170.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.221 0 N-CA-C 109.981 -1.248 . . . . 73.42 109.981 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.5 t -140.83 -154.55 0.52 Allowed 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 128.118 2.567 . . . . 64.44 107.544 -164.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -59.25 -26.37 64.84 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 123.161 0.584 . . . . 72.01 111.978 177.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -72.73 -37.21 67.82 Favored 'General case' 0 C--O 1.227 -0.097 0 CA-C-N 118.539 0.609 . . . . 72.03 110.009 -176.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.461 ' CE2' HD11 ' A' ' 9' ' ' LEU . 41.5 t80 -49.39 -57.95 6.01 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.1 1.36 . . . . 51.2 112.643 -166.237 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.447 ' HA ' HD12 ' A' ' 9' ' ' LEU . 22.4 tp60 -64.28 -35.91 82.39 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 118.821 0.737 . . . . 63.01 112.03 -177.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -69.61 -38.03 77.11 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 109.467 -0.568 . . . . 62.1 109.467 -178.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 mp -62.69 -43.13 99.59 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 124.6 1.16 . . . . 63.2 109.73 172.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.461 HD11 ' CE2' ' A' ' 5' ' ' PHE . 59.5 mt -62.35 -16.33 53.76 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.596 -0.69 . . . . 35.15 112.583 178.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 27.6 t0 -104.6 -6.81 20.16 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.242 1.417 . . . . 63.14 112.171 176.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -81.02 13.6 2.66 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 126.447 1.899 . . . . 72.24 112.693 -168.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 96.84 4.36 58.98 Favored Glycine 0 CA--C 1.526 0.77 0 C-N-CA 125.307 1.432 . . . . 44.42 112.43 -171.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 43.9 mt -102.81 158.0 32.62 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 118.727 1.264 . . . . 74.41 110.55 -162.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -62.01 -164.42 0.04 OUTLIER 'Trans proline' 0 CA--C 1.539 0.733 1 C-N-CA 126.304 4.67 . . . . 74.42 112.916 172.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -85.77 -54.98 4.19 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 120.379 -1.451 . . . . 74.1 109.599 161.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 35.3 mmtm -50.42 -48.98 55.98 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 124.412 1.085 . . . . 74.51 113.818 -164.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 61.9 t -63.81 -46.9 93.11 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 125.175 1.39 . . . . 51.44 107.696 -173.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.14 -38.3 68.04 Favored 'General case' 0 C--N 1.343 0.286 0 CA-C-N 118.476 0.58 . . . . 62.22 111.313 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.73 -16.78 62.0 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 114.09 1.145 . . . . 75.54 114.09 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.5 2.25 16.24 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 119.873 1.215 . . . . 74.2 113.346 170.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 19.9 tp -103.55 -34.23 8.74 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.7 1.2 . . . . 74.0 111.058 -173.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -56.32 -40.71 74.84 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.272 0.487 . . . . 75.45 110.997 176.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -44.62 -44.7 9.12 Favored 'General case' 0 C--N 1.332 -0.154 0 C-N-CA 128.908 2.883 . . . . 74.35 112.357 174.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mt -66.8 -19.8 26.19 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 C-N-CA 124.711 1.205 . . . . 74.32 110.23 -174.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -100.37 -13.19 18.88 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.428 1.091 . . . . 75.25 112.637 176.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 72.5 t -89.06 -30.14 5.25 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.328 1.051 . . . . 75.34 111.165 176.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -85.01 10.76 11.02 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.115 -0.991 . . . . 75.33 112.973 -167.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.62 24.8 76.07 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 124.177 0.894 . . . . 74.11 113.815 176.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 11.0 mt -79.7 -83.75 0.1 Allowed 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 127.229 2.212 . . . . 75.31 107.032 168.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -120.63 165.99 15.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 C-N-CA 123.685 0.794 . . . . 54.51 112.931 -170.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.89 155.01 24.32 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 125.145 1.378 . . . . 64.02 109.436 164.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.5 p80 -76.1 -12.97 60.21 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 118.312 -0.851 . . . . 72.34 113.172 -175.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.1 m -124.91 36.15 4.65 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 126.169 1.788 . . . . 75.14 110.364 178.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 22.6 t0 -81.57 15.04 2.25 Favored 'General case' 0 CA--C 1.54 0.561 0 O-C-N 120.981 -1.075 . . . . 75.15 112.88 172.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -113.25 177.17 4.72 Favored 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.276 -1.515 . . . . 72.41 111.077 -163.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -112.81 160.4 18.04 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.46 1.104 . . . . 75.21 109.232 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tp10 -54.3 -45.23 72.52 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.277 1.031 . . . . 74.11 109.428 173.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 53.4 mtt85 -58.87 -25.96 63.81 Favored 'General case' 0 N--CA 1.455 -0.202 0 C-N-CA 123.939 0.896 . . . . 73.31 111.685 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -76.93 -45.09 29.05 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.894 0.77 . . . . 72.04 109.557 176.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 9.1 mm -58.47 -40.39 78.39 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 C-N-CA 123.953 0.901 . . . . 55.23 109.394 -179.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.73 -38.64 91.3 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.632 0.651 . . . . 72.03 110.188 -177.761 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.14 -33.45 65.51 Favored 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 124.59 1.156 . . . . 51.22 111.536 -173.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 mt -56.16 -46.09 79.42 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 119.179 0.899 . . . . 74.2 112.791 177.613 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -22.77 64.41 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 122.842 0.457 . . . . 64.4 111.824 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.4 mm-40 -75.62 -12.35 60.19 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 113.136 0.791 . . . . 72.04 113.136 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -88.81 164.52 15.18 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-N 119.614 1.097 . . . . 74.0 109.703 173.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -101.73 -175.84 2.96 Favored 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 125.347 1.459 . . . . 75.44 109.42 169.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -46.25 -58.58 3.55 Favored 'General case' 0 N--CA 1.435 -1.213 0 C-N-CA 125.527 1.531 . . . . 72.21 112.633 178.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -64.64 -46.15 83.75 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 108.186 -1.042 . . . . 73.22 108.186 -178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -58.83 -52.38 53.54 Favored Glycine 0 C--N 1.341 0.843 0 N-CA-C 111.3 -0.72 . . . . 62.23 111.3 -174.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.5 -45.97 91.83 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.557 0.743 . . . . 43.3 110.908 179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 62.0 mt -61.74 -40.12 93.96 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 118.46 0.573 . . . . 75.34 111.186 179.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 80' ' ' TYR . . . -65.3 -41.33 94.21 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.148 0.431 . . . . 74.1 111.419 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 74.8 t -59.44 -41.81 85.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 123.594 0.758 . . . . 63.13 109.681 175.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 11.2 mt -72.77 -41.9 64.55 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 123.185 0.594 . . . . 71.13 110.452 -174.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -54.9 -52.15 63.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 108.68 -0.859 . . . . 53.22 108.68 175.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -68.11 -34.13 75.81 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 119.239 -0.984 . . . . 62.43 110.26 -172.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -65.35 -53.84 37.74 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 122.856 0.462 . . . . 63.42 110.188 177.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.29 -41.8 76.5 Favored 'General case' 0 C--N 1.34 0.195 0 CA-C-N 119.003 0.819 . . . . 75.21 110.002 -179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -88.37 16.22 6.68 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 112.72 0.637 . . . . 72.44 112.72 -175.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.18 165.82 11.52 Favored 'General case' 0 N--CA 1.466 0.362 0 O-C-N 120.248 -1.532 . . . . 75.21 112.563 -179.407 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -88.61 93.21 9.48 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 113.587 -1.642 . . . . 63.55 110.333 -178.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -87.83 53.62 2.83 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.838 1.255 . . . . 75.43 110.166 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.6 p -61.94 83.71 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 127.729 2.412 . . . . 75.43 112.279 179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 10.3 m80 51.46 33.55 10.5 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.365 1.466 . . . . 72.32 112.38 176.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.449 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -52.16 111.49 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.561 0 C-N-CA 127.111 2.164 . . . . 63.42 110.55 179.014 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -56.68 -55.17 37.44 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.724 -0.61 . . . . 74.15 112.576 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 29.3 p-10 -114.05 84.3 2.01 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 126.184 1.794 . . . . 72.15 109.292 -167.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.449 ' HD3' HG13 ' A' ' 66' ' ' VAL . 41.6 mmtm -56.35 -26.83 53.97 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 124.676 1.191 . . . . 75.25 113.503 -172.387 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -68.05 -50.07 57.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 128.32 2.648 . . . . 54.52 109.262 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.8 -38.41 90.89 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 124.8 1.24 . . . . 72.04 110.405 -176.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -61.8 -47.86 83.22 Favored 'General case' 0 C--O 1.23 0.073 0 N-CA-C 109.153 -0.684 . . . . 73.42 109.153 176.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 25.3 tp -57.79 -52.59 64.82 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 109.336 -0.616 . . . . 63.45 109.336 -178.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 51.6 t -49.76 -40.32 40.78 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.904 0.882 . . . . 73.24 111.197 174.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -44.64 94.25 Favored Glycine 0 CA--C 1.528 0.892 0 C-N-CA 123.826 0.727 . . . . 54.35 111.808 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 38.3 t -65.03 -43.03 96.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.453 0 O-C-N 122.087 -0.655 . . . . 63.34 109.799 176.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 26.0 mtt -57.79 -40.25 79.43 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 120.799 -1.188 . . . . 62.42 111.323 177.399 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 36.5 tttm -51.82 -59.6 4.13 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 118.256 -0.878 . . . . 72.43 109.789 179.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 8.9 t -62.2 -34.49 76.56 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.898 0.772 . . . . 75.24 111.553 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.422 ' CE1' ' HB1' ' A' ' 53' ' ' ALA . 11.5 m-85 -68.06 -37.65 81.53 Favored 'General case' 0 CA--C 1.529 0.157 0 O-C-N 120.603 -1.311 . . . . 75.21 113.1 -179.244 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.2 mmt85 -65.86 -45.9 80.42 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 118.867 0.758 . . . . 75.11 109.229 166.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -107.08 69.44 0.76 Allowed 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 124.484 1.114 . . . . 53.31 110.75 -161.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -123.68 -2.76 8.32 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 113.339 0.866 . . . . 74.3 113.339 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -74.59 112.34 10.68 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 106.573 -1.64 . . . . 72.03 106.573 155.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm . . . . . 0 C--O 1.246 0.876 0 C-N-CA 127.157 2.183 . . . . 74.44 106.639 161.099 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.462 ' HA2' ' OD1' ' A' ' 22' ' ' ASP . . . . . . . . 0 N--CA 1.467 0.753 0 N-CA-C 110.345 -1.102 . . . . 74.03 110.345 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 t -75.35 -170.21 1.16 Allowed 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.125 0.97 . . . . 61.11 109.031 166.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.27 -35.74 78.33 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 125.119 1.368 . . . . 53.24 111.823 167.898 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -58.87 -26.95 64.72 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.065 0.946 . . . . 63.22 112.811 -169.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 66.3 t80 -45.86 -41.37 11.15 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 126.492 1.917 . . . . 73.0 112.575 175.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.5 tp60 -70.12 -37.42 75.32 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.869 -0.586 . . . . 71.32 111.847 -175.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 86.8 m -65.26 -39.5 92.73 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.977 0.808 . . . . 42.1 109.005 171.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 40.2 mt -59.57 -48.15 82.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 118.751 0.705 . . . . 63.05 111.66 -177.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 23.5 mt -51.74 -38.96 57.56 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 123.95 0.9 . . . . 74.0 110.854 174.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -91.92 -6.96 50.46 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.092 0.557 . . . . 64.44 112.026 -174.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -86.86 2.17 50.0 Favored 'General case' 0 N--CA 1.456 -0.163 0 O-C-N 120.411 -1.431 . . . . 75.33 110.928 179.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 120.79 -22.75 8.05 Favored Glycine 0 CA--C 1.523 0.536 0 C-N-CA 124.358 0.98 . . . . 32.12 112.013 -178.563 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 78.9 mt -78.15 144.82 67.88 Favored Pre-proline 0 C--O 1.236 0.385 0 CA-C-N 117.675 0.737 . . . . 65.41 110.936 -159.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.47 156.23 61.71 Favored 'Trans proline' 0 N--CA 1.45 -1.047 0 C-N-CA 121.708 1.606 . . . . 74.02 109.361 164.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -59.4 -39.97 85.13 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 124.192 0.997 . . . . 70.01 108.83 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -56.11 -45.87 79.33 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 112.193 0.442 . . . . 74.13 112.193 -178.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 92.3 t -69.69 -50.38 50.38 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 N-CA-C 108.254 -1.017 . . . . 72.15 108.254 176.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.92 -42.71 65.64 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.466 0.706 . . . . 61.15 111.7 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -59.24 -55.6 32.87 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 119.127 0.876 . . . . 62.42 110.935 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -68.14 -30.51 69.67 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 118.593 -0.718 . . . . 71.11 111.166 -175.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 34.4 tp -76.39 -36.91 57.84 Favored 'General case' 0 C--O 1.224 -0.276 0 C-N-CA 124.505 1.122 . . . . 72.04 110.609 -178.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.462 ' OD1' ' HA2' ' A' ' 1' ' ' GLY . 1.1 t70 -55.5 -39.57 70.64 Favored 'General case' 0 C--N 1.331 -0.216 0 C-N-CA 123.749 0.82 . . . . 64.25 110.755 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.67 -29.63 69.41 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 125.783 1.633 . . . . 74.04 112.299 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.439 HG22 HG22 ' A' ' 30' ' ' VAL . 2.4 mt -65.33 -33.07 61.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.539 0 N-CA-C 107.662 -1.236 . . . . 72.35 107.662 -176.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.439 ' CE1' ' HA ' ' A' ' 32' ' ' HIS . 11.0 m-85 -90.48 7.82 36.97 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.382 1.873 . . . . 75.24 112.951 -179.724 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.8 t -99.15 -38.01 6.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.252 0 O-C-N 121.186 -0.947 . . . . 55.15 109.444 173.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -76.34 -17.45 59.4 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.25 0.833 . . . . 72.11 113.25 -165.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.4 13.18 52.58 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-N 118.413 0.551 . . . . 44.25 111.819 -173.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 70.9 mt -78.06 -55.29 5.4 Favored 'General case' 0 CA--C 1.519 -0.213 0 N-CA-C 108.709 -0.848 . . . . 71.45 108.709 -178.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.439 HG22 HG22 ' A' ' 24' ' ' ILE . 21.3 m -140.16 156.54 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 C-N-CA 123.42 0.688 . . . . 74.33 109.873 174.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -80.17 158.66 26.25 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 109.236 -0.653 . . . . 74.12 109.236 164.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.439 ' HA ' ' CE1' ' A' ' 25' ' ' TYR . 19.2 p80 -62.26 -24.62 67.37 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.786 -0.571 . . . . 73.12 112.14 174.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.6 t -107.7 15.74 24.33 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.173 0.989 . . . . 75.01 111.793 178.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.38 -23.88 64.72 Favored 'General case' 0 N--CA 1.476 0.845 0 O-C-N 120.591 -1.318 . . . . 73.32 110.989 171.827 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.18 173.95 9.46 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 126.015 1.726 . . . . 73.11 110.599 -174.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -130.32 175.37 9.0 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.205 1.002 . . . . 73.35 108.87 173.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -44.83 -45.14 9.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 127.443 2.297 . . . . 73.11 114.589 -171.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 14.1 mtp180 -60.75 -21.85 63.43 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.958 0.799 . . . . 62.02 112.063 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -66.77 -58.73 4.49 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.218 1.007 . . . . 40.11 109.993 172.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.479 ' H ' HD12 ' A' ' 40' ' ' ILE . 4.4 mp -56.31 -44.89 80.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.42 1.088 . . . . 62.15 110.924 -179.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -55.45 -48.64 74.17 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.697 1.199 . . . . 73.32 110.987 177.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.26 -39.42 86.12 Favored 'General case' 0 C--O 1.222 -0.378 0 CA-C-O 118.408 -0.806 . . . . 72.33 111.101 -177.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.2 mt -52.95 -37.59 61.24 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-O 118.767 -0.635 . . . . 74.34 111.338 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.79 -29.48 67.86 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.211 0.819 . . . . 72.05 113.211 174.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 25.7 mt-10 -66.99 -21.4 65.96 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 119.72 1.146 . . . . 71.24 111.366 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -88.27 143.58 26.94 Favored 'General case' 0 N--CA 1.448 -0.543 0 C-N-CA 124.323 1.049 . . . . 73.03 110.928 179.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 18.6 p-10 -69.04 178.52 2.21 Favored 'General case' 0 C--N 1.326 -0.413 0 C-N-CA 126.734 2.013 . . . . 64.02 111.292 163.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -51.14 -65.28 0.58 Allowed 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 126.797 2.039 . . . . 43.52 110.939 178.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -37.67 76.06 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.723 0.809 . . . . 73.13 110.603 -171.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.74 -37.05 66.84 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 111.431 -0.667 . . . . 33.33 111.431 -175.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.52 91.8 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 117.587 0.693 . . . . 71.12 109.496 174.012 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 mt -56.41 -37.86 70.76 Favored 'General case' 0 N--CA 1.463 0.219 0 O-C-N 121.949 -0.47 . . . . 72.14 111.038 -179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -63.46 -47.53 81.47 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 118.291 0.496 . . . . 72.35 112.271 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 37.4 t -51.45 -38.31 20.37 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.801 0.728 . . . . 75.22 110.277 173.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 48.1 mt -73.2 -53.54 10.67 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.331 0.653 . . . . 61.31 109.923 -176.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -55.1 -43.18 73.79 Favored 'General case' 0 C--O 1.234 0.246 0 O-C-N 124.001 0.813 . . . . 64.25 110.106 -176.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -69.11 -31.13 69.62 Favored 'General case' 0 N--CA 1.45 -0.44 0 O-C-N 123.036 0.21 . . . . 63.43 110.957 -174.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -73.3 -49.46 27.38 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 124.148 0.979 . . . . 75.32 111.461 -178.78 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.8 mtpt -60.71 -38.76 86.15 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 119.876 1.216 . . . . 51.21 109.733 175.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -82.31 5.36 20.41 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 113.137 0.791 . . . . 74.33 113.137 177.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 90.6 p -74.44 170.65 15.24 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 119.929 1.24 . . . . 34.43 111.224 -179.168 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -96.86 98.73 10.35 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 107.955 -1.128 . . . . 42.23 107.955 173.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 81.1 mt -98.99 25.39 6.74 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 124.482 1.113 . . . . 75.34 109.848 177.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.7 t -67.07 -38.86 86.51 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.26 -0.9 . . . . 64.44 111.16 -177.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 19.0 m170 -130.97 23.65 4.94 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 124.046 0.938 . . . . 72.12 112.396 -170.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.45 165.57 1.4 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.475 0 C-N-CA 124.393 1.077 . . . . 72.12 110.016 165.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -122.32 -85.68 0.65 Allowed 'General case' 0 C--O 1.234 0.256 0 N-CA-C 106.577 -1.638 . . . . 73.34 106.577 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -73.58 116.88 14.69 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 107.889 -1.152 . . . . 75.43 107.889 176.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.439 ' HB3' HG12 ' A' ' 30' ' ' VAL . 40.7 mmtm -64.15 -35.92 82.35 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 121.621 -0.674 . . . . 63.04 111.865 -179.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -58.11 -52.51 65.22 Favored 'General case' 0 CA--C 1.516 -0.36 0 C-N-CA 126.193 1.797 . . . . 74.03 108.095 -176.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -62.54 -25.01 67.82 Favored 'General case' 0 N--CA 1.441 -0.881 0 CA-C-N 115.357 -0.838 . . . . 53.12 112.768 -175.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -74.85 -52.88 10.2 Favored 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.715 -0.846 . . . . 62.35 108.715 176.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.488 HD11 ' CE ' ' A' ' 77' ' ' MET . 0.7 OUTLIER -61.28 -52.99 62.4 Favored 'General case' 0 CA--C 1.517 -0.303 0 CA-C-O 122.49 1.138 . . . . 75.04 109.109 -173.476 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.0 t -62.96 -20.75 65.55 Favored 'General case' 0 CA--C 1.544 0.745 0 CA-C-N 114.407 -1.27 . . . . 72.34 110.741 -176.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.94 -53.44 5.79 Favored Glycine 0 C--N 1.34 0.787 0 CA-C-O 117.408 -1.773 . . . . 73.15 110.878 172.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 53.7 t -47.72 -50.58 9.02 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 CA-C-N 119.148 1.474 . . . . 34.4 109.327 178.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.488 ' CE ' HD11 ' A' ' 73' ' ' LEU . 6.6 mtt -53.46 -50.98 64.15 Favored 'General case' 0 N--CA 1.455 -0.202 0 CA-C-O 119.6 -0.238 . . . . 62.33 111.007 178.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.548 ' HA ' HH11 ' A' ' 81' ' ' ARG . 3.5 ttmt -59.67 -47.44 85.61 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 118.612 -0.709 . . . . 74.45 110.621 -177.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 7.1 m -60.2 -38.58 83.73 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 118.134 -0.936 . . . . 53.43 111.064 179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -56.89 -58.18 9.24 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.871 1.214 . . . . 71.22 111.1 177.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.548 HH11 ' HA ' ' A' ' 78' ' ' LYS . 6.2 ptp85 -57.88 -35.41 70.94 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-O 118.033 -0.984 . . . . 62.35 110.974 179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -107.35 36.75 2.6 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 126.662 1.985 . . . . 71.35 114.381 -172.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -74.83 72.62 2.07 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 120.308 -1.495 . . . . 62.41 110.98 174.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -94.08 88.53 5.69 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.309 -2.108 . . . . 64.52 105.309 164.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 19.3 mmmt . . . . . 0 C--O 1.249 1.07 0 CA-C-O 116.126 -1.892 . . . . 71.12 108.241 -146.392 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.462 0.372 0 N-CA-C 109.74 -1.344 . . . . 50.21 109.74 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 t -127.36 -177.29 4.02 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 124.288 1.994 . . . . 70.14 111.196 -171.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -68.48 -20.14 64.58 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 113.555 -1.657 . . . . 62.52 112.794 167.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p30 -74.43 -27.64 60.7 Favored 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 119.591 1.087 . . . . 64.34 111.05 -179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -44.95 -53.46 7.63 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 125.324 1.45 . . . . 74.1 111.913 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 37.1 tp60 -64.32 -37.8 88.79 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.97 0.508 . . . . 74.12 112.204 179.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 m -64.19 -48.78 74.61 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 108.895 -0.78 . . . . 53.13 108.895 178.396 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 9.0 mp -58.87 -42.71 90.1 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 124.094 0.958 . . . . 74.44 110.846 178.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 16.8 mt -56.59 -27.26 57.59 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.707 0.803 . . . . 74.43 111.034 177.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -101.05 -3.2 29.78 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 119.002 0.819 . . . . 54.31 112.764 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -89.5 10.31 23.29 Favored 'General case' 0 C--O 1.239 0.55 0 O-C-N 120.522 -1.361 . . . . 74.52 112.679 -169.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 104.85 3.43 42.63 Favored Glycine 0 CA--C 1.527 0.804 0 C-N-CA 125.331 1.443 . . . . 70.21 113.072 -176.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 22.3 mt -111.68 157.73 38.54 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 118.785 1.293 . . . . 70.22 111.201 -163.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.43 167.89 18.77 Favored 'Trans proline' 0 N--CA 1.458 -0.594 0 C-N-CA 123.169 2.579 . . . . 65.4 111.657 174.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 43.8 tt0 -66.01 -47.42 74.53 Favored 'General case' 0 CA--C 1.512 -0.497 0 C-N-CA 124.615 1.166 . . . . 50.13 109.177 178.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.32 -43.27 83.17 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 120.525 -0.47 . . . . 74.34 111.155 -172.503 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 70.5 t -63.77 -53.84 39.57 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 107.566 -1.272 . . . . 71.1 107.566 174.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.22 -51.34 45.05 Favored 'General case' 0 C--O 1.223 -0.294 0 C-N-CA 124.334 1.054 . . . . 54.2 111.628 -174.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -55.18 -45.37 75.79 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 118.805 0.73 . . . . 73.41 111.536 -178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -77.07 -38.85 51.72 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 118.449 -0.786 . . . . 72.0 111.031 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.19 -39.24 71.93 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 126.451 1.9 . . . . 70.32 111.099 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -57.01 -42.26 79.99 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 124.981 1.313 . . . . 73.14 111.075 -177.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -64.93 -22.66 67.04 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.319 1.448 . . . . 74.12 113.03 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.443 HG23 ' HE3' ' A' ' 59' ' ' LYS . 9.4 mt -70.76 -22.25 23.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 O-C-N 121.068 -1.02 . . . . 73.23 108.571 176.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -102.77 23.55 11.94 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 126.683 1.993 . . . . 70.5 112.126 -178.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 91.8 t -115.45 -38.92 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.269 1.028 . . . . 72.5 110.419 174.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.28 5.55 14.4 Favored 'General case' 0 CA--C 1.54 0.559 0 O-C-N 121.511 -0.743 . . . . 71.1 112.945 -171.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 92.43 -8.84 76.93 Favored Glycine 0 CA--C 1.529 0.951 0 C-N-CA 127.329 2.395 . . . . 71.51 113.539 177.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 58.3 mt -61.96 -60.84 3.03 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 126.419 1.887 . . . . 72.13 110.084 -165.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 m -130.34 179.16 4.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.257 -0.883 . . . . 72.01 109.88 174.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -122.71 164.69 17.83 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 124.465 1.106 . . . . 73.22 109.13 172.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -59.7 -12.09 6.35 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 114.08 1.141 . . . . 74.43 114.08 -173.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -132.63 23.99 4.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 125.01 1.324 . . . . 65.14 112.564 -177.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -73.84 30.66 0.08 Allowed 'General case' 0 CA--C 1.548 0.869 0 O-C-N 120.591 -1.318 . . . . 74.31 111.382 169.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.6 mt -125.18 -177.48 3.88 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 127.079 2.152 . . . . 44.41 110.353 -163.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -137.06 163.03 31.73 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 107.04 -1.467 . . . . 64.22 107.04 172.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -55.93 -37.99 69.68 Favored 'General case' 0 C--N 1.328 -0.338 0 C-N-CA 125.647 1.579 . . . . 74.4 111.51 -175.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.0 ptt180 -55.53 -36.69 67.02 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 113.659 0.985 . . . . 45.53 113.659 174.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -78.07 -40.5 38.38 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 109.413 -0.588 . . . . 72.41 109.413 179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 20.3 mm -60.78 -44.1 96.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 C-N-CA 122.995 0.518 . . . . 72.0 110.268 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -64.46 -50.92 65.6 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 123.466 0.706 . . . . 65.31 109.819 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.53 -30.24 71.15 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 117.644 -1.17 . . . . 45.14 112.68 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 9.5 mt -60.85 -46.39 90.76 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 119.973 1.261 . . . . 51.14 110.066 171.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.78 -40.94 98.88 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 118.022 0.374 . . . . 71.31 110.389 178.443 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -76.73 43.51 0.34 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.485 1.114 . . . . 62.4 111.999 176.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -138.41 149.59 45.66 Favored 'General case' 0 C--O 1.233 0.193 0 O-C-N 121.087 -1.008 . . . . 72.42 108.317 162.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 8.9 p-10 -68.62 163.66 23.21 Favored 'General case' 0 CA--C 1.512 -0.489 0 C-N-CA 125.331 1.452 . . . . 73.12 110.358 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -47.83 -70.99 0.08 Allowed 'General case' 0 N--CA 1.443 -0.811 0 C-N-CA 127.455 2.302 . . . . 63.43 110.864 -179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -70.52 -23.28 62.61 Favored 'General case' 0 CA--C 1.529 0.148 0 O-C-N 122.28 -0.263 . . . . 74.12 111.24 -172.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -66.85 -60.74 5.83 Favored Glycine 0 C--N 1.344 0.986 0 N-CA-C 109.938 -1.265 . . . . 70.43 109.938 176.305 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -47.63 -40.94 20.93 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.582 1.953 . . . . 53.32 111.884 173.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.51 -46.86 83.29 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.668 1.187 . . . . 72.11 111.576 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -56.71 -45.84 81.6 Favored 'General case' 0 CA--C 1.528 0.128 0 CA-C-O 121.036 0.446 . . . . 73.32 109.837 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 2.3 t -57.74 -37.89 62.11 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 C-N-CA 123.283 0.633 . . . . 74.44 110.975 177.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.6 mt -67.56 -45.37 75.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 O-C-N 121.192 -0.942 . . . . 73.4 109.938 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 29.7 tt0 -56.04 -49.73 72.91 Favored 'General case' 0 N--CA 1.449 -0.505 0 N-CA-C 108.98 -0.748 . . . . 70.0 108.98 175.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -65.41 -28.2 69.08 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 118.14 0.427 . . . . 74.31 111.878 -174.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.8 t80 -77.86 -33.89 51.95 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.764 0.826 . . . . 62.41 112.943 173.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.443 ' HE3' HG23 ' A' ' 24' ' ' ILE . 0.1 OUTLIER -63.04 -37.84 88.81 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 120.82 -1.175 . . . . 72.0 110.005 168.902 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -83.76 52.63 2.32 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 127.903 2.481 . . . . 74.41 109.995 -175.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -150.62 170.97 17.88 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.42 1.088 . . . . 71.3 110.457 170.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.46 77.4 1.09 Allowed 'General case' 0 N--CA 1.445 -0.68 0 C-N-CA 125.746 1.619 . . . . 73.21 108.017 -169.561 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 95.3 mt -77.17 49.53 0.69 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.161 1.384 . . . . 74.41 110.977 -175.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.4 t -111.12 -21.51 11.9 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 126.201 1.8 . . . . 72.22 112.205 -175.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 20.5 m80 -130.64 16.58 5.33 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 124.239 1.016 . . . . 71.34 111.776 176.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 90.5 t -90.52 104.85 15.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.385 0 N-CA-C 107.586 -1.264 . . . . 63.41 107.586 -178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 pm0 -58.43 -35.42 72.07 Favored 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.709 0.633 . . . . 65.23 112.709 175.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 42.5 p30 -129.07 78.74 1.87 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.988 0.899 . . . . 42.3 111.472 -170.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.419 ' HG2' ' H ' ' A' ' 69' ' ' LYS . 44.0 mmtt -48.26 -40.68 25.46 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.516 1.526 . . . . 72.41 110.445 177.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 8.6 p -55.22 -61.01 2.61 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 128.443 2.697 . . . . 72.23 111.364 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.7 -29.81 70.4 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-O 119.111 -0.471 . . . . 72.1 111.278 -177.566 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -63.07 -52.23 63.57 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 108.466 -0.939 . . . . 72.12 108.466 173.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 17.0 tp -56.84 -47.06 81.2 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.047 1.339 . . . . 74.13 109.836 178.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -61.94 -27.13 68.62 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.012 0.925 . . . . 72.42 111.907 178.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.76 -54.84 6.96 Favored Glycine 0 C--N 1.336 0.54 0 N-CA-C 109.603 -1.399 . . . . 71.14 109.603 176.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 89.0 t -52.36 -48.14 45.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 123.867 0.867 . . . . 74.14 109.562 177.521 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 36.2 mtt -50.25 -52.27 37.57 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.908 -1.12 . . . . 63.02 111.237 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.52 -38.28 89.34 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-O 118.01 -0.995 . . . . 61.21 111.184 -171.532 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 2.6 t -67.74 -28.29 67.51 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.954 1.252 . . . . 74.32 111.178 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 57.7 m-85 -71.32 -46.27 61.06 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.57 1.532 . . . . 74.31 110.612 169.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.78 24.71 0.06 Allowed 'General case' 0 N--CA 1.48 1.04 0 O-C-N 120.419 -1.426 . . . . 73.13 113.068 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.98 15.23 4.25 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.015 2.126 . . . . 73.31 111.753 174.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 72.3 mtp85 -134.65 38.38 3.06 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.095 0.862 . . . . 74.01 111.18 -172.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -81.34 130.76 35.17 Favored 'General case' 0 N--CA 1.448 -0.549 0 N-CA-C 108.276 -1.009 . . . . 73.02 108.276 175.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.545 ' HE2' ' HA ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER . . . . . 0 C--O 1.254 1.333 0 C-N-CA 126.848 2.059 . . . . 65.32 106.307 -173.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.53 0 N-CA-C 110.574 -1.01 . . . . 64.23 110.574 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.9 m -69.18 179.73 1.84 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-O 121.382 0.61 . . . . 64.12 109.536 157.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -49.48 -35.9 21.21 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 125.356 1.463 . . . . 64.45 113.002 178.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.73 -34.6 74.65 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 124.184 0.993 . . . . 75.45 109.771 -166.344 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -44.77 -54.57 6.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.004 1.322 . . . . 61.12 110.486 176.34 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.6 tp60 -66.56 -31.62 72.45 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 117.974 -1.013 . . . . 63.45 111.848 -176.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.8 m -60.08 -46.73 88.62 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.74 1.155 . . . . 75.25 109.63 172.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.45 -40.48 95.81 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.206 -0.934 . . . . 62.25 110.963 178.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.41 -20.09 65.25 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.796 0.725 . . . . 72.52 112.139 177.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -86.87 -36.78 18.24 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 124.366 1.066 . . . . 71.24 109.081 175.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.33 -18.06 64.28 Favored 'General case' 0 C--O 1.232 0.155 0 C-N-CA 126.599 1.96 . . . . 72.34 113.38 -166.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 125.87 17.0 2.61 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 119.322 -0.71 . . . . 55.13 113.176 177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.3 mt -112.8 148.08 38.55 Favored Pre-proline 0 C--O 1.239 0.509 0 CA-C-N 118.133 0.966 . . . . 60.13 111.96 -156.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -69.07 154.19 70.89 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 122.793 2.328 . . . . 74.41 109.112 174.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -69.0 -40.88 78.44 Favored 'General case' 0 N--CA 1.44 -0.937 0 N-CA-C 108.024 -1.102 . . . . 62.55 108.024 -168.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.77 -56.53 18.31 Favored 'General case' 0 N--CA 1.444 -0.754 0 O-C-N 123.741 0.65 . . . . 52.05 109.862 -175.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 39.7 t -58.36 -45.37 89.54 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 N-CA-C 108.166 -1.05 . . . . 74.54 108.166 -178.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.75 -39.24 80.36 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.367 0.877 . . . . 73.21 113.367 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -55.5 -35.74 65.91 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 123.6 0.76 . . . . 64.34 111.1 178.335 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -91.84 -15.89 27.54 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 125.232 1.413 . . . . 74.44 111.544 -173.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.581 HD23 ' HE2' ' A' ' 25' ' ' TYR . 0.1 OUTLIER -79.45 -38.54 34.4 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 124.787 1.235 . . . . 63.53 111.799 171.631 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -52.68 -48.2 66.68 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 123.949 0.9 . . . . 61.43 109.628 -171.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -64.91 -5.25 5.67 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 127.082 2.153 . . . . 75.11 115.092 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.1 mt -90.82 -10.72 9.99 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 124.386 1.074 . . . . 75.41 109.544 173.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.581 ' HE2' HD23 ' A' ' 21' ' ' LEU . 67.5 m-85 -109.93 6.29 23.1 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.218 1.407 . . . . 74.14 113.95 -178.06 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 25.2 t -120.14 -5.82 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.643 0 C-N-CA 124.779 1.232 . . . . 73.33 111.819 -173.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -109.68 6.22 23.54 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 120.269 -1.519 . . . . 74.11 112.311 -172.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 76.19 12.54 84.05 Favored Glycine 0 CA--C 1.53 1.018 0 C-N-CA 124.181 0.895 . . . . 31.23 113.614 -175.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 71.3 mt -74.69 -65.19 0.89 Allowed 'General case' 0 C--O 1.233 0.199 0 C-N-CA 126.608 1.963 . . . . 73.15 109.628 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 6.9 m -129.84 156.98 42.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 N-CA-C 113.765 1.024 . . . . 75.44 113.765 171.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.97 149.86 39.21 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 125.605 1.562 . . . . 70.55 109.945 161.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.4 p80 -55.92 -47.96 76.57 Favored 'General case' 0 C--O 1.228 -0.062 0 C-N-CA 123.634 0.773 . . . . 61.11 110.962 175.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.1 t -83.77 3.2 34.43 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 112.346 0.498 . . . . 70.44 112.346 -172.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -67.48 -28.49 67.9 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.763 -1.211 . . . . 72.15 111.911 -174.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -69.67 155.24 40.82 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 109.311 -0.625 . . . . 74.52 109.311 -177.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.9 m-20 -111.61 167.02 10.66 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.388 -0.968 . . . . 74.1 108.388 -178.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -54.16 -37.42 64.43 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.041 0.536 . . . . 72.34 112.313 -175.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -54.84 -39.52 68.66 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 118.24 0.473 . . . . 73.0 111.828 176.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.02 -39.28 66.12 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-O 118.955 -0.545 . . . . 61.43 110.955 177.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 25.6 mm -62.66 -46.05 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.972 0.805 . . . . 63.43 108.99 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -60.39 -55.73 30.06 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 125.854 1.662 . . . . 71.03 110.298 174.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.86 -40.65 76.52 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 122.852 0.461 . . . . 61.21 111.176 -177.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 23.7 mt -57.49 -52.49 65.18 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.226 1.011 . . . . 73.24 110.642 173.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.53 -18.95 3.19 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 117.575 -1.202 . . . . 63.32 113.6 171.651 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -86.37 -7.13 58.7 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 121.896 2.134 . . . . 60.21 114.877 -179.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -90.15 -177.34 5.12 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.547 1.521 . . . . 74.11 110.948 -174.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -105.67 173.52 6.28 Favored 'General case' 0 CA--C 1.512 -0.495 0 C-N-CA 124.971 1.308 . . . . 62.42 108.962 162.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.2 tt0 -53.85 -69.87 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 C-N-CA 126.065 1.746 . . . . 75.42 111.144 -176.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -68.47 -10.81 57.91 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 125.86 1.664 . . . . 75.3 111.581 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.504 ' O ' HG23 ' A' ' 54' ' ' VAL . . . -74.24 -72.98 0.96 Allowed Glycine 0 C--N 1.339 0.719 0 N-CA-C 108.504 -1.838 . . . . 62.22 108.504 172.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -51.83 -36.95 49.95 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.142 0.977 . . . . 74.23 112.343 177.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.0 tp -62.73 -44.97 94.82 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.909 0.884 . . . . 64.3 111.137 177.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -62.5 -45.65 92.04 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.822 0.737 . . . . 63.02 111.698 170.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLY . 57.3 t -56.62 -30.97 33.26 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.978 1.311 . . . . 74.21 110.503 -178.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.6 mt -68.19 -45.91 72.13 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 125.426 1.49 . . . . 75.51 110.791 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -54.37 -42.62 70.53 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 109.247 -0.649 . . . . 75.31 109.247 179.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -76.91 0.88 19.31 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 113.738 1.014 . . . . 63.12 113.738 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -110.39 -41.16 4.44 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.786 1.635 . . . . 73.3 111.402 171.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -28.47 68.18 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 120.432 -1.417 . . . . 72.2 111.029 175.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -82.59 1.75 36.57 Favored 'General case' 0 CA--C 1.545 0.754 0 CA-C-O 118.625 -0.702 . . . . 53.31 112.716 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.5 m -92.45 -176.11 4.21 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 120.341 1.428 . . . . 71.24 111.105 -179.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -127.99 79.88 1.93 Allowed 'General case' 0 C--O 1.24 0.566 0 C-N-CA 126.024 1.73 . . . . 62.4 109.246 -170.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.45 HD22 ' H ' ' A' ' 63' ' ' LEU . 1.0 OUTLIER -86.1 -6.43 59.02 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 120.038 -1.664 . . . . 72.44 113.309 -162.813 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -48.1 -62.3 1.54 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.585 1.954 . . . . 62.54 111.651 -175.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 48.8 m80 -86.31 2.04 48.8 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.551 0.74 . . . . 72.14 112.462 -171.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.95 151.58 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.259 -0.901 . . . . 71.13 109.504 -179.108 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -83.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.414 1.886 . . . . 61.13 108.868 174.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -98.33 117.74 33.41 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.569 -1.271 . . . . 74.44 107.569 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 27.3 mmtm -56.6 -39.25 73.26 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 119.03 0.832 . . . . 70.31 110.859 174.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -66.19 -47.38 74.12 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 124.631 1.172 . . . . 74.3 110.446 -174.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -65.29 -23.67 67.09 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 120.431 -0.507 . . . . 51.42 111.71 179.362 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -64.34 -55.49 20.81 Favored 'General case' 0 C--N 1.339 0.127 0 N-CA-C 107.873 -1.158 . . . . 65.4 107.873 173.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -52.98 -50.68 63.65 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.24 1.816 . . . . 64.31 110.559 179.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.61 -22.01 66.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 116.113 -0.494 . . . . 74.4 111.835 -177.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -65.43 -52.09 42.89 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.214 -1.154 . . . . 51.51 110.214 172.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 91.4 t -55.3 -46.4 78.14 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 123.735 0.814 . . . . 74.01 109.033 176.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 46.4 mtt -55.37 -41.62 72.85 Favored 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 113.077 0.769 . . . . 73.42 113.077 175.838 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -58.29 -46.83 85.37 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 118.932 0.787 . . . . 60.13 109.238 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 1.4 m -57.8 -56.14 25.84 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 123.065 0.546 . . . . 71.0 109.944 178.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.495 ' CG ' HG22 ' A' ' 54' ' ' VAL . 22.8 m-85 -55.39 -43.58 75.32 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.976 0.807 . . . . 62.04 111.527 -178.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.78 -3.22 37.17 Favored 'General case' 0 CA--C 1.539 0.548 0 O-C-N 120.93 -1.106 . . . . 71.42 113.847 -177.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -130.7 79.13 1.88 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 126.0 1.72 . . . . 72.12 107.714 171.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -142.77 105.95 4.58 Favored 'General case' 0 N--CA 1.446 -0.672 0 C-N-CA 127.563 2.345 . . . . 54.13 107.252 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -102.11 129.5 48.46 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 106.575 -1.639 . . . . 74.12 106.575 163.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 18.4 tptp . . . . . 0 C--O 1.253 1.289 0 N-CA-C 103.696 -2.705 . . . . 75.02 103.696 168.445 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.481 ' HA3' ' OD2' ' A' ' 22' ' ' ASP . . . . . . . . 0 CA--C 1.505 -0.59 0 N-CA-C 109.691 -1.364 . . . . 73.24 109.691 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.0 m -137.97 -168.55 2.37 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 123.04 0.536 . . . . 73.12 110.012 -163.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -57.21 -29.27 63.6 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.057 0.943 . . . . 74.23 112.616 -177.11 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -66.86 -37.4 84.37 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 123.424 0.69 . . . . 72.05 109.3 -165.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 79.5 t80 -46.35 -59.86 2.68 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 123.577 0.751 . . . . 63.25 111.132 177.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -60.91 -45.93 92.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.976 -0.535 . . . . 73.25 112.228 -175.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.6 t -68.34 -26.58 65.68 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 119.385 0.993 . . . . 70.04 110.824 -178.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.44 -35.22 77.3 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 119.857 -1.777 . . . . 73.14 110.339 171.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -64.28 -20.39 66.04 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.529 1.059 . . . . 51.44 111.536 174.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.06 -17.83 21.53 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.408 0.683 . . . . 61.22 112.361 175.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.61 9.51 1.39 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.227 1.411 . . . . 71.03 112.448 179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.11 17.6 71.6 Favored Glycine 0 CA--C 1.529 0.931 0 C-N-CA 124.566 1.079 . . . . 33.2 113.096 177.714 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 32.1 mt -103.76 156.32 35.77 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.403 1.081 . . . . 72.32 110.684 -173.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.16 160.03 46.19 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.051 3.167 . . . . 74.23 113.062 176.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 30.6 tt0 -63.88 -45.7 88.19 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 123.717 0.807 . . . . 74.34 109.248 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -23.67 65.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 118.901 -1.12 . . . . 52.12 112.353 -168.037 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 53.7 t -70.66 -56.94 9.13 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.252 0 N-CA-C 106.726 -1.583 . . . . 62.24 106.726 168.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.01 -40.21 60.64 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 119.385 0.993 . . . . 71.04 113.058 -175.251 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.52 -15.19 57.21 Favored 'General case' 0 C--N 1.331 -0.231 0 C-N-CA 125.52 1.528 . . . . 71.21 113.667 179.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.3 -18.87 12.4 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.651 1.581 . . . . 73.23 112.108 173.56 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 14.2 tp -92.42 -29.65 16.17 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 126.15 1.78 . . . . 74.33 111.581 -173.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.481 ' OD2' ' HA3' ' A' ' 1' ' ' GLY . 5.9 t0 -56.97 -43.88 82.09 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 123.495 0.718 . . . . 73.41 110.416 -179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.54 -34.25 66.88 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 126.902 2.081 . . . . 74.25 113.811 177.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.482 HD12 ' HE2' ' A' ' 59' ' ' LYS . 11.5 mm -58.85 -20.69 17.53 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 123.932 0.893 . . . . 74.33 109.289 178.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.491 ' CD1' ' HA ' ' A' ' 32' ' ' HIS . 39.5 m-85 -104.67 9.53 35.12 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 125.676 1.59 . . . . 74.12 112.968 177.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 63.9 t -116.21 -32.39 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 C-N-CA 125.593 1.557 . . . . 75.21 111.068 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -83.68 24.22 0.89 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.847 0.859 . . . . 74.35 111.19 -176.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 73.69 12.01 80.62 Favored Glycine 0 CA--C 1.53 1.021 0 C-N-CA 125.98 1.753 . . . . 74.03 113.93 177.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.697 HD13 ' HE3' ' A' ' 59' ' ' LYS . 2.2 mt -73.78 -63.89 1.11 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.873 1.337 . . . . 64.03 110.527 -168.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.55 158.71 42.09 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 124.392 1.077 . . . . 54.42 113.465 -169.45 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.15 13.04 0.61 Allowed 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 127.732 2.413 . . . . 54.15 115.47 -172.187 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 25' ' ' TYR 0.258 6.7 p-80 56.11 -21.77 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.939 2.496 . . . . 71.04 116.604 -161.452 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -129.28 23.9 5.55 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.59 1.556 . . . . 74.01 111.409 -177.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -70.15 19.13 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 126.617 1.967 . . . . 64.23 113.766 -175.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 58.8 mt -129.22 -171.83 2.59 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.439 1.496 . . . . 72.42 110.701 -152.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -145.91 169.74 17.99 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 126.969 2.107 . . . . 74.0 107.806 175.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -47.28 -46.03 24.47 Favored 'General case' 0 N--CA 1.462 0.129 0 C-N-CA 126.537 1.935 . . . . 73.5 112.423 -169.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 18.4 ptt180 -54.97 -29.32 56.62 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.746 0.647 . . . . 74.2 112.746 -179.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.63 -47.81 65.67 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-O 118.828 -0.606 . . . . 74.04 110.605 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.523 ' H ' HD12 ' A' ' 40' ' ' ILE . 3.6 mp -71.19 -43.46 74.86 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 119.024 0.829 . . . . 71.41 109.707 -179.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -67.87 -48.09 67.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-O 119.129 -0.462 . . . . 62.12 110.456 -173.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.97 -22.5 64.11 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 119.014 0.825 . . . . 73.34 111.985 -177.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 8.5 mt -59.05 -37.5 77.16 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.575 1.08 . . . . 71.23 111.847 166.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 24.0 mmtm -65.82 -25.63 67.31 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 118.803 0.729 . . . . 70.54 111.544 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -87.77 21.75 2.52 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.422 -0.799 . . . . 70.21 111.976 -167.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -125.37 156.93 37.98 Favored 'General case' 0 N--CA 1.454 -0.236 0 O-C-N 120.924 -1.11 . . . . 54.13 109.95 175.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 15.7 p-10 -67.94 169.71 9.46 Favored 'General case' 0 CA--C 1.513 -0.452 0 CA-C-N 115.702 -0.681 . . . . 65.42 109.534 155.696 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -50.27 -58.86 4.7 Favored 'General case' 0 N--CA 1.432 -1.355 0 C-N-CA 125.727 1.611 . . . . 73.51 109.603 174.45 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -74.71 -4.04 35.03 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.317 1.047 . . . . 50.34 112.26 -174.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -86.12 -57.09 2.18 Favored Glycine 0 C--N 1.337 0.632 0 N-CA-C 109.055 -1.618 . . . . 61.21 109.055 164.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.94 -45.99 89.08 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 124.94 1.296 . . . . 73.32 112.233 -175.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -59.74 -44.29 93.85 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 119.18 0.9 . . . . 73.34 110.572 177.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -59.65 -43.89 93.72 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 120.571 -0.451 . . . . 54.43 111.226 176.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 61.1 t -54.34 -41.11 51.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 O-C-N 121.285 -0.884 . . . . 62.5 110.264 175.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 13.5 mt -64.54 -52.22 58.83 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 109.4 -0.593 . . . . 74.3 109.4 -178.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -58.18 -33.67 69.5 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 123.759 0.662 . . . . 75.12 109.609 -174.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -91.87 -27.77 17.73 Favored 'General case' 0 C--N 1.34 0.182 0 CA-C-N 118.69 0.677 . . . . 72.53 111.745 -171.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -62.08 -20.96 64.56 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 121.469 0.652 . . . . 73.2 110.971 164.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.697 ' HE3' HD13 ' A' ' 29' ' ' LEU . 0.4 OUTLIER -102.57 -19.47 14.84 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 113.594 0.961 . . . . 64.3 113.594 176.322 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -80.5 59.99 3.72 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 126.059 1.744 . . . . 60.51 107.003 158.598 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 24.1 m -158.1 163.72 37.35 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 125.526 1.531 . . . . 71.1 107.708 170.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -105.92 128.91 54.09 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 105.137 -2.171 . . . . 74.51 105.137 171.723 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.0 mt -116.35 44.83 1.9 Allowed 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.701 2.4 . . . . 75.22 109.004 -172.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 30.3 m -59.08 95.58 0.03 OUTLIER 'General case' 0 C--O 1.236 0.371 0 C-N-CA 123.726 0.81 . . . . 71.41 111.395 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' HIS . . . . . . . . . . . . . 9.7 m170 49.14 35.05 6.56 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 128.309 2.643 . . . . 75.44 113.485 177.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.445 HG13 ' HD3' ' A' ' 69' ' ' LYS . 1.7 p -60.02 111.53 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 107.682 -1.229 . . . . 74.11 107.682 169.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.2 tm0? -67.23 -40.12 86.31 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 120.705 -1.247 . . . . 63.34 109.762 168.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -78.32 50.45 0.93 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.201 1.4 . . . . 60.11 112.514 -170.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' HD3' HG13 ' A' ' 66' ' ' VAL . 35.1 mmtm -52.71 -39.93 62.49 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 120.946 -1.096 . . . . 72.41 112.196 -177.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 2.7 p -66.13 -53.35 38.91 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 124.325 1.05 . . . . 72.53 110.14 -179.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -60.47 -38.45 84.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 119.1 -0.476 . . . . 74.13 110.723 -179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -62.58 -49.55 74.81 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 108.93 -0.767 . . . . 75.21 108.93 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 23.0 tp -62.68 -50.61 70.46 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 123.89 0.876 . . . . 73.24 109.795 -177.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 4.5 t -64.93 -21.82 66.89 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.106 0.962 . . . . 33.14 110.943 -178.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -70.37 -53.46 13.29 Favored Glycine 0 C--N 1.336 0.55 0 C-N-CA 126.063 1.792 . . . . 71.51 110.795 169.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 97.3 t -55.81 -47.93 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 CA-C-N 118.736 1.268 . . . . 73.23 108.652 176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 44.7 mtt -48.05 -56.9 6.63 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.95 0.9 . . . . 72.22 110.839 172.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.3 ttmm -59.13 -43.53 92.0 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.882 -0.784 . . . . 73.23 108.882 -175.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 3.2 m -60.99 -35.34 76.58 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-O 119.244 -0.408 . . . . 70.32 111.647 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -65.83 -42.53 90.41 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.558 -1.339 . . . . 72.2 112.71 175.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -79.35 -15.91 57.14 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-O 118.407 -0.806 . . . . 72.14 113.108 178.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -142.41 88.74 2.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.535 1.934 . . . . 71.11 107.327 -174.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.3 ptt85 -124.89 3.04 8.1 Favored 'General case' 0 N--CA 1.473 0.725 0 C-N-CA 126.331 1.852 . . . . 61.52 112.898 -168.494 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -56.97 118.72 5.25 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 124.713 1.205 . . . . 65.23 108.226 169.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.255 1.362 0 N-CA-C 105.041 -2.207 . . . . 74.13 105.041 173.443 . . . . . . . . 1 1 . 1 stop_ save_