data_2ld7_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 2ld7 _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 145' ' ' THR . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -59.02 132.79 49.36 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.546 2.164 . . . . 0.0 111.737 -178.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -102.72 138.23 39.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.239 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.68 125.3 40.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.297 0.57 . . . . 0.0 111.277 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 19.5 t0 -81.81 114.38 20.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.589 174.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.632 HD21 HD12 ' B' ' 504' ' ' LEU . 56.3 mt -100.01 -0.45 39.22 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.335 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -82.66 -19.36 38.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.503 -179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.494 ' NE2' ' HA ' ' B' ' 504' ' ' LEU . 28.8 pt20 -71.01 -26.8 63.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.847 178.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.508 HD23 HD13 ' B' ' 504' ' ' LEU . 86.5 mt -65.25 149.21 50.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.687 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -65.73 152.53 44.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.223 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.47 HG21 ' HD3' ' A' ' 175' ' ' LYS . 57.6 t -55.93 -40.1 60.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.309 0.576 . . . . 0.0 109.796 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.84 -39.04 93.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.527 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.0 m -64.21 -44.77 90.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.14 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.07 -41.7 90.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.15 0.5 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.63 -32.39 73.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.418 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.584 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.2 ttm180 -67.47 -44.46 78.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.013 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -51.5 -49.58 61.59 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.063 0.458 . . . . 0.0 110.224 172.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.667 ' HZ2' ' HB3' ' A' ' 162' ' ' LYS . 9.4 mtpm? -63.52 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.884 -178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -79.89 -39.14 31.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.636 0.255 . . . . 0.0 111.328 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -77.87 -32.82 52.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.96 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -91.06 -4.95 55.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.971 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.8 mptt 56.67 81.78 0.13 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.539 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.416 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 90.3 mt -116.8 95.36 46.33 Favored Pre-proline 0 C--N 1.325 -0.466 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 21.0 Cg_endo -61.73 127.27 21.1 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.798 2.332 . . . . 0.0 111.405 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 10.8 p . . . . . 0 C--N 1.319 -0.738 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.221 -174.505 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.4 mt . . . . . 0 C--O 1.234 0.284 0 CA-C-O 120.948 0.404 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.568 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 13.9 m120 -121.42 174.96 6.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.258 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.62 ' O ' HG22 ' A' ' 179' ' ' VAL . 20.7 tptm -54.88 -53.1 59.8 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.473 0.483 . . . . 0.0 111.371 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.38 -39.01 85.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.675 0.274 . . . . 0.0 111.196 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -62.12 -46.29 89.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.271 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 84.7 mt -59.05 -49.68 76.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.62 HG22 ' O ' ' A' ' 175' ' ' LYS . 39.0 t -58.73 -40.54 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.344 -176.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -64.72 -49.17 71.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.929 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.32 -47.82 88.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.821 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.24 -47.71 89.4 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.177 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . 0.503 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -62.45 -38.96 97.18 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.671 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.46 -41.94 99.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -81.04 -31.6 34.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.651 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.98 -27.87 69.13 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 122.87 0.468 . . . . 0.0 110.922 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 63.5 mttp -72.8 -6.71 46.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.34 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.9 t -133.09 60.74 1.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 110.704 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.967 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 68.8 mt -110.75 119.0 47.37 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.169 175.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.01 129.24 19.12 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.074 2.516 . . . . 0.0 111.214 175.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.0 p -142.45 154.65 18.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.696 -173.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.42 122.01 21.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.628 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 29.0 tt0 -48.79 -64.13 0.89 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.413 0.445 . . . . 0.0 112.146 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -56.86 -53.04 62.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -172.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -66.88 -42.13 86.09 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.712 -176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.7 m -64.92 -40.79 95.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.978 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 52.5 mt -63.38 -43.9 96.29 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 53.9 m -58.58 -48.99 79.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.097 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 74.7 m -58.36 -48.73 79.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.863 0.364 . . . . 0.0 110.704 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.521 ' CD1' HD21 ' B' ' 488' ' ' LEU . 42.2 t80 -57.33 -55.65 32.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.079 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.488 HD13 ' HE2' ' B' ' 468' ' ' PHE . 85.4 mt -57.64 -45.48 86.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.243 0.544 . . . . 0.0 110.57 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.88 -59.83 4.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.191 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 68.8 m -62.36 -45.4 93.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -174.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.477 HG12 HD22 ' B' ' 523' ' ' LEU . 51.6 t -67.39 -35.32 73.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.37 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 . . . . . 0 C--N 1.328 -0.342 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.109 178.097 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 463' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 11.6 t . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 121.13 0.491 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -66.6 -44.0 83.29 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 10.7 t -65.24 -33.28 75.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.43 ' HB3' ' O ' ' B' ' 463' ' ' THR . 53.9 tp -60.73 -49.22 78.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.992 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.482 ' O ' HG23 ' B' ' 471' ' ' VAL . 78.1 t80 -55.78 -51.74 66.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.364 176.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.488 ' HE2' HD13 ' A' ' 201' ' ' ILE . 30.7 m-85 -65.45 -34.97 79.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.535 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.62 -45.44 94.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -58.85 -48.75 80.26 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.812 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 467' ' ' PHE . 63.3 t -58.92 -47.07 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.875 0.369 . . . . 0.0 110.658 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -39.37 90.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -79.85 -30.77 40.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.196 -175.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' B' ' 512' ' ' PHE . . . -80.0 -47.69 14.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.611 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 24.9 mt -66.53 -40.39 89.11 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.371 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 71.25 -46.05 0.63 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.525 0.73 . . . . 0.0 112.692 173.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 33.8 t -72.13 136.68 46.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.671 0.272 . . . . 0.0 110.493 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.82 97.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.823 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.55 -29.65 64.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -68.34 -42.38 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.408 . . . . 0.0 110.425 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -67.48 -37.36 82.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 44.6 tt0 -60.26 -42.1 94.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 174.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.462 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 19.5 t-20 -53.59 -49.16 68.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.277 176.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -54.07 -47.69 71.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.29 0.567 . . . . 0.0 110.507 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.01 -31.62 72.29 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.134 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.967 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 17.1 mtt85 -67.49 -37.55 83.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.39 . . . . 0.0 110.258 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.4 m -62.17 -36.37 81.67 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.521 HD21 ' CD1' ' A' ' 200' ' ' PHE . 34.4 mt -66.46 -47.43 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.287 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.464 HG23 ' HA ' ' B' ' 486' ' ' ARG . 12.6 m -64.7 -42.45 95.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.756 -0.377 . . . . 0.0 111.902 -177.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.416 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 26.1 pt -69.22 -31.27 49.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.988 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -63.96 -45.74 87.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -64.49 -35.94 82.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -81.92 17.57 1.52 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.693 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 64.22 29.54 13.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 111.064 172.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.584 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 95.8 t -93.33 -55.12 6.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.377 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 41.3 pt -104.35 149.49 8.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.802 -0.359 . . . . 0.0 111.194 -176.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.401 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.1 m -78.64 173.77 12.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.512 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -57.78 -58.82 6.7 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.219 0.533 . . . . 0.0 111.076 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . 0.648 ' HA ' HG22 ' B' ' 502' ' ' VAL . . . -60.81 -38.04 84.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.933 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.401 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 7.9 mm-40 -56.4 -38.3 71.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.195 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.9 tp -64.84 -52.46 56.56 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.942 177.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.648 HG22 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -62.72 -40.66 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.929 -178.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -67.48 -37.74 83.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.422 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.632 HD12 HD21 ' A' ' 150' ' ' LEU . 10.7 tp -62.37 -41.78 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.746 0.308 . . . . 0.0 111.181 -174.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 18.0 m -86.11 14.24 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.855 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 48.3 t -57.53 -51.41 81.91 Favored Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 178.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.1 Cg_exo -61.38 -8.42 10.58 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.137 1.891 . . . . 0.0 112.738 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.58 -61.5 1.52 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.302 -177.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.461 HD22 HG11 ' B' ' 471' ' ' VAL . 46.4 mt -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.364 -173.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.62 68.43 Favored Glycine 0 N--CA 1.454 -0.118 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.744 -176.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.29 0.567 . . . . 0.0 110.185 178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.46 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 45.7 m-85 -115.76 98.11 50.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.244 -175.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . 0.46 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.8 Cg_endo -54.17 -46.36 34.16 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.398 2.732 . . . . 0.0 113.211 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -61.81 -38.5 88.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.175 0.512 . . . . 0.0 110.892 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.48 -47.09 35.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.546 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.594 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 11.8 t80 -69.36 -32.22 71.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.738 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -70.14 -40.32 74.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.226 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -54.84 -48.36 72.98 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.593 ' O ' ' HG ' ' B' ' 523' ' ' LEU . 8.4 t80 -56.79 -49.71 74.53 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.652 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.594 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 94.8 mttt -59.01 -44.74 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.529 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -64.14 -35.24 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.812 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -71.79 -38.9 70.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.569 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 519' ' ' PHE . 68.0 mt -77.1 -13.45 59.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.221 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 70.36 43.46 62.3 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -173.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 46.5 t80 . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 120.987 0.422 . . . . 0.0 109.998 -177.131 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.0 m . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.733 0.301 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.418 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 32.4 Cg_exo -57.07 136.29 75.76 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 111.392 174.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -110.06 166.07 11.23 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.667 -176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.526 HG11 ' ND2' ' B' ' 483' ' ' ASN . 6.8 p -114.01 140.48 34.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.861 176.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 12.5 t70 -106.33 124.52 49.72 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.415 HD11 HG13 ' A' ' 182' ' ' VAL . 61.7 mt -104.05 2.53 32.25 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.393 0.616 . . . . 0.0 110.624 -177.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -86.39 -21.92 26.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.758 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 19.0 pt20 -73.34 -17.57 61.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.835 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.491 HD12 HD22 ' B' ' 504' ' ' LEU . 76.2 mt -75.1 173.1 11.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.269 0.557 . . . . 0.0 111.621 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -87.6 144.8 26.5 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.33 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.538 HG11 ' CD1' ' A' ' 178' ' ' LEU . 55.3 t -54.08 -42.26 54.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.516 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.69 -35.41 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.145 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.6 m -69.83 -42.02 74.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.767 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.47 ' O ' ' HG3' ' A' ' 162' ' ' LYS . 74.7 mt -64.56 -40.94 96.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.226 178.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 159' ' ' ARG . 27.9 mtp85 -64.71 -37.42 87.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.594 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.435 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 35.2 ttm105 -66.25 -38.85 88.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.446 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.488 ' HA ' HG11 ' B' ' 495' ' ' VAL . 60.4 t80 -56.44 -51.52 68.08 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.275 172.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.61 ' HZ1' ' HB2' ' A' ' 167' ' ' LEU . 7.4 mtpm? -60.97 -35.19 76.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.457 -177.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -76.43 -34.91 58.76 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.929 -176.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -77.16 -42.4 37.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.338 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.421 ' CE1' HG23 ' B' ' 490' ' ' ILE . 58.2 m-85 -89.63 3.01 53.96 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.465 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 54.5 74.57 0.34 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.7 0.625 . . . . 0.0 111.307 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.61 ' HB2' ' HZ1' ' A' ' 162' ' ' LYS . 84.8 mt -111.05 144.56 30.64 Favored Pre-proline 0 C--N 1.328 -0.353 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.093 -177.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.47 162.58 33.26 Favored 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.041 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--N 1.323 -0.56 0 CA-C-O 120.949 0.404 . . . . 0.0 111.286 179.921 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 75.2 mt . . . . . 0 C--O 1.233 0.219 0 CA-C-O 121.122 0.486 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.405 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 8.2 t-20 -154.63 -171.67 3.93 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.642 ' O ' HG22 ' A' ' 179' ' ' VAL . 19.4 tptm -64.09 -62.1 1.84 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.731 0.241 . . . . 0.0 111.251 -176.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.21 -30.13 64.3 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.701 0.286 . . . . 0.0 111.383 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.405 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 8.9 mm-40 -59.02 -55.29 37.1 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.67 0.748 . . . . 0.0 110.393 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.538 ' CD1' HG11 ' A' ' 155' ' ' VAL . 53.4 mt -64.29 -41.56 96.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.661 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.642 HG22 ' O ' ' A' ' 175' ' ' LYS . 23.6 t -60.48 -37.92 76.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.773 -178.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.99 -53.26 48.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.874 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 55.3 mt -60.32 -49.33 84.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 121.01 0.433 . . . . 0.0 110.744 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.415 HG13 HD11 ' A' ' 150' ' ' LEU . 77.5 t -59.17 -49.09 84.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.939 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.58 -37.32 94.0 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.439 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 29.1 t -61.97 -42.36 99.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.93 0.395 . . . . 0.0 110.907 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 -87.26 -25.11 24.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.387 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.422 ' HE1' HD11 ' B' ' 490' ' ' ILE . 73.9 t80 -62.22 -43.58 98.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.104 0.478 . . . . 0.0 110.651 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -80.94 8.13 9.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.566 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 3.2 p -125.12 14.18 8.4 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.805 0.336 . . . . 0.0 111.274 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.415 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 75.6 mt -79.58 120.75 81.24 Favored Pre-proline 0 C--O 1.235 0.321 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.55 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.99 115.96 4.49 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.994 2.463 . . . . 0.0 111.294 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.455 HG22 ' HB3' ' B' ' 485' ' ' LEU . 3.8 p -127.89 156.21 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.068 -174.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . 0.502 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 18.9 m120 -128.97 138.33 51.89 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.716 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 27.1 tt0 -55.54 -67.28 0.3 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -72.7 -36.47 67.84 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.777 0.322 . . . . 0.0 110.965 -172.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . 0.502 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 12.1 t70 -55.25 -49.6 71.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.993 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 90.4 m -75.54 -35.35 60.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.501 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 35.7 mt -58.45 -46.62 86.17 Favored 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.9 m -61.49 -43.53 98.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.0 m -58.08 -50.99 71.54 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.875 0.369 . . . . 0.0 111.013 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.45 ' CD1' HD21 ' B' ' 488' ' ' LEU . 76.2 t80 -65.1 -47.13 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.574 -175.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 197' ' ' LEU . 77.5 mt -61.95 -45.71 98.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.034 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -66.42 -35.96 81.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.496 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.9 m -62.41 -61.33 2.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 99.4 t -61.91 -39.71 84.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.855 -174.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 . . . . . 0 C--N 1.33 -0.246 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.742 -178.788 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 120.492 0.187 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -63.59 -53.63 48.59 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -60.67 -33.45 72.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.606 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.32 -50.7 71.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.247 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.452 ' O ' HG22 ' B' ' 471' ' ' VAL . 59.5 t80 -52.62 -51.31 60.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.774 175.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.41 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 60.4 m-85 -65.02 -34.61 78.83 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.53 -38.16 88.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.935 0.398 . . . . 0.0 110.134 176.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -63.95 -47.06 81.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.223 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.469 HG12 HD21 ' B' ' 509' ' ' LEU . 75.2 t -58.74 -45.24 91.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 110.465 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -59.33 -38.06 79.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -79.01 -41.38 29.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.183 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.53 ' HB2' ' CE2' ' B' ' 512' ' ' PHE . . . -67.27 -43.41 81.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.184 -174.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.02 -30.65 69.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.095 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 69.23 -59.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.526 0 O-C-N 123.942 0.776 . . . . 0.0 112.104 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 32.8 t -69.06 135.09 50.26 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.238 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.17 81.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.245 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.27 -39.24 82.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.259 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.418 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.31 -45.85 89.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.104 0.478 . . . . 0.0 110.326 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.419 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 55.3 t80 -66.81 -31.5 72.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.113 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.647 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 33.5 tt0 -65.49 -42.94 91.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.668 176.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.526 ' ND2' HG11 ' A' ' 148' ' ' VAL . 5.5 m-20 -55.67 -46.28 77.58 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.817 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -55.94 -46.79 78.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.455 ' HB3' HG22 ' A' ' 191' ' ' VAL . 90.5 mt -67.73 -32.69 73.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.647 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -61.3 -41.33 96.8 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 120.815 0.341 . . . . 0.0 110.183 173.381 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.6 m -62.48 -35.49 79.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.224 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.45 HD21 ' CD1' ' A' ' 200' ' ' PHE . 40.2 mt -68.51 -47.19 67.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.435 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.5 m -65.33 -40.81 89.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.665 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.437 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.8 pt -69.44 -32.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.735 178.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -65.18 -42.79 93.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.21 0.529 . . . . 0.0 109.727 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.19 -38.23 82.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.87 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -86.79 15.95 5.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.475 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 60.5 26.34 15.98 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.752 0.421 . . . . 0.0 111.631 177.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 161' ' ' TYR . 53.6 t -77.13 -48.48 24.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 38.4 pt -113.3 155.58 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.997 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.436 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 81.4 p -96.27 -173.32 2.76 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -54.88 -59.54 4.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.0 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.51 83.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.962 -173.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.537 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 6.7 mm-40 -59.19 -44.0 92.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.425 0.631 . . . . 0.0 109.908 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.508 HD21 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -62.3 -46.07 90.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.226 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -32.9 59.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.728 -178.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -71.57 -39.9 70.29 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.491 HD22 HD12 ' A' ' 153' ' ' LEU . 74.9 mt -65.05 -38.73 91.76 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.885 0.374 . . . . 0.0 111.891 -177.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 34.9 m -84.92 11.41 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.583 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.637 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 43.8 t -61.03 -52.21 73.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.865 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.637 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 32.2 Cg_exo -63.61 -15.93 51.62 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.898 1.732 . . . . 0.0 112.378 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.417 ' CD2' ' HB2' ' A' ' 146' ' ' PRO . 94.9 m-85 -90.56 -65.73 0.99 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.082 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.469 HD21 HG12 ' B' ' 471' ' ' VAL . 87.9 mt -92.33 -5.13 52.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.438 -173.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.64 -17.1 68.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.431 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -72.57 -21.1 61.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 176.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.53 ' CE2' ' HB2' ' B' ' 474' ' ' ALA . 22.6 m-85 -123.28 86.47 51.71 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.682 -176.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.7 -46.49 29.73 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 123.155 2.57 . . . . 0.0 113.185 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -65.07 -37.55 87.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.871 0.367 . . . . 0.0 111.249 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 20.7 tp -70.4 -38.73 74.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.296 0.57 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.591 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 54.0 t80 -65.38 -35.39 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.828 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -70.01 -32.86 71.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.057 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -59.14 -48.85 80.07 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -56.28 -46.7 79.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.522 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.591 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 92.6 mttt -60.64 -41.01 94.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.186 176.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -61.58 -30.56 70.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -75.92 -39.32 56.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.286 0.565 . . . . 0.0 109.928 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.508 HD21 HD21 ' B' ' 501' ' ' LEU . 10.2 mp -80.76 -24.64 38.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.074 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 95.03 30.55 8.24 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.787 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.451 -0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.05 155.12 57.48 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.187 1.925 . . . . 0.0 111.737 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.29 137.04 51.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.131 0.491 . . . . 0.0 111.714 -172.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.46 133.59 28.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.086 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -87.38 -26.81 23.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.215 0.531 . . . . 0.0 111.109 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 74.6 mt 64.15 13.77 8.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.227 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.14 -16.03 34.53 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.05 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.8 -15.08 60.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.328 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.401 HD22 HG22 ' A' ' 157' ' ' THR . 81.2 mt -67.44 140.4 57.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.53 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.19 157.83 36.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.797 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 88.7 t -56.16 -44.17 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.855 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -64.31 -36.58 84.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.808 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.401 HG22 HD22 ' A' ' 153' ' ' LEU . 10.4 m -63.58 -46.58 85.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.629 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 68.5 mt -62.48 -42.73 99.69 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.743 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 66.4 mtp85 -70.08 -28.81 65.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.499 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 33.7 ttm180 -72.34 -44.6 62.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.499 ' HH ' HD12 ' A' ' 189' ' ' ILE . 57.7 t80 -51.98 -51.22 58.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.081 172.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.938 ' HZ3' HG23 ' A' ' 181' ' ' ILE . 19.8 mtpp -65.97 -29.73 70.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.279 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -81.84 -42.67 19.29 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.701 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 -68.39 -32.77 73.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.874 -175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -95.7 0.11 52.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.151 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 57.64 77.53 0.27 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.016 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 77.0 mt -120.67 134.85 24.31 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.78 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.75 155.15 65.23 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.908 2.405 . . . . 0.0 113.114 -173.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.632 ' HB ' HD11 ' A' ' 173' ' ' LEU . 67.8 p . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.358 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.632 HD11 ' HB ' ' A' ' 169' ' ' THR . 79.6 mt . . . . . 0 CA--C 1.518 -0.272 0 CA-C-O 121.217 0.532 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.514 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 93.2 m-20 -131.11 172.95 11.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.184 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.582 ' O ' HG21 ' A' ' 179' ' ' VAL . 21.5 tptm -56.39 -53.9 51.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.353 0.408 . . . . 0.0 110.339 176.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -62.05 -34.21 75.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.423 -178.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.514 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.6 mm100 -67.03 -41.74 86.06 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.032 0.444 . . . . 0.0 110.879 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 88.0 mt -61.22 -47.87 84.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.837 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 175' ' ' LYS . 35.6 t -60.19 -32.61 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.801 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 13.2 mm-40 -61.97 -57.45 11.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 110.691 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.938 HG23 ' HZ3' ' A' ' 162' ' ' LYS . 38.6 mt -61.69 -43.2 96.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.676 -178.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 178' ' ' LEU . 71.8 t -59.64 -49.0 85.35 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.316 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.2 -40.86 99.54 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.314 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 41.2 t -55.85 -42.73 76.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 111.195 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -86.38 -30.49 22.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.873 0.368 . . . . 0.0 111.3 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.41 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 64.2 t80 -63.87 -32.01 73.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.145 -177.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.63 14.64 1.59 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.54 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 43.0 m -147.45 34.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.692 0.282 . . . . 0.0 111.457 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.903 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 72.4 mt -93.31 114.92 64.16 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.752 -0.203 . . . . 0.0 110.613 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.29 127.24 18.69 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.67 2.247 . . . . 0.0 110.892 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 9.0 p -144.61 149.76 16.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.739 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . 0.669 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 12.6 m-80 -112.52 155.42 24.34 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.1 tt0 -71.64 -66.68 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -178.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -73.49 -43.79 59.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.253 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 15.0 t70 -52.64 -48.4 66.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.998 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 36.7 m -71.3 -42.76 68.25 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.338 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 55.0 mt -56.8 -45.94 81.91 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.147 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 18.2 m -62.19 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.906 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 79.4 m -59.8 -49.86 76.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.865 0.364 . . . . 0.0 110.918 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.535 ' O ' HG21 ' A' ' 204' ' ' VAL . 76.6 t80 -60.86 -55.31 34.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.826 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.49 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 76.0 mt -54.35 -50.41 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.669 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -58.34 -43.34 88.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.782 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 -43.82 92.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.488 -179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 200' ' ' PHE . 17.8 t -73.5 -22.29 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-O 121.34 0.591 . . . . 0.0 110.562 -178.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 9.9 mmm180 . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.138 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.989 0.423 . . . . 0.0 111.64 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.567 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.4 mp0 -57.17 -36.01 70.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.73 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 31.8 t -61.17 -43.04 99.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.224 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.426 HD23 ' C ' ' B' ' 466' ' ' LEU . 9.4 tt -62.75 -46.01 90.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.728 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.558 ' O ' HG21 ' B' ' 471' ' ' VAL . 81.5 t80 -52.88 -59.53 4.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.543 177.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.443 ' HE2' HD11 ' A' ' 201' ' ' ILE . 51.3 m-85 -65.18 -36.21 83.49 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -174.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.47 -45.18 94.21 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . 0.405 ' HD2' HD11 ' B' ' 515' ' ' LEU . 23.6 ttmm -67.8 -40.85 83.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.637 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.558 HG21 ' O ' ' B' ' 467' ' ' PHE . 77.2 t -56.21 -48.6 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.903 0.383 . . . . 0.0 110.462 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.07 -45.21 83.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.381 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -76.94 -37.04 56.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.666 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -69.61 -41.08 76.19 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -176.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.13 -32.56 73.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.422 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 40.2 ttt180 69.28 -1.63 2.11 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.875 0.735 . . . . 0.0 111.875 173.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 21.4 t -127.14 131.31 50.79 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.23 -35.66 80.04 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.106 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.01 -37.87 81.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.342 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.24 -37.5 78.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.859 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -68.87 -37.69 79.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.003 0.43 . . . . 0.0 109.907 177.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.9 tt0 -61.37 -42.44 98.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.474 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 1.7 t-20 -52.21 -51.41 58.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.036 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 87.8 t80 -52.71 -47.62 67.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.682 177.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.03 -33.31 75.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.203 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.903 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.8 mtt180 -66.37 -37.74 85.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 176.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 84.1 m -61.18 -36.3 79.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.864 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.535 HD22 ' CG ' ' A' ' 200' ' ' PHE . 62.0 mt -68.89 -45.84 69.93 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.566 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.474 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -64.62 -42.31 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.478 -178.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.427 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 17.6 pt -69.18 -32.02 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.608 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.85 -44.3 90.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.079 0.466 . . . . 0.0 109.987 172.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -68.85 -16.68 63.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.831 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -101.37 16.49 25.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.27 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 65.56 10.84 6.99 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.425 0.453 . . . . 0.0 111.647 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.499 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 78.9 t -70.55 -47.22 66.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.915 0.388 . . . . 0.0 110.807 -176.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.6 pt -112.07 179.71 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.182 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.496 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.0 m -119.8 170.95 8.77 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.057 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.509 ' O ' HG22 ' B' ' 502' ' ' VAL . 55.6 ttp180 -50.57 -56.52 11.37 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.519 0.512 . . . . 0.0 111.384 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.34 -43.65 83.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.336 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.496 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 12.4 mm-40 -56.01 -49.0 74.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.362 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.463 HD22 ' C ' ' B' ' 501' ' ' LEU . 8.9 tt -61.64 -46.27 90.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.765 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.509 HG22 ' O ' ' B' ' 498' ' ' ARG . 90.2 t -59.76 -36.69 67.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -82.32 -27.12 32.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.468 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 20.7 mt -65.0 -43.19 93.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.004 0.43 . . . . 0.0 111.528 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.495 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.4 p -84.63 11.51 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.108 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 32.9 t -59.73 -50.07 88.61 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.158 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.459 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 11.5 Cg_endo -60.56 -8.2 8.56 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.255 1.97 . . . . 0.0 113.308 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.459 ' CE2' ' HG2' ' B' ' 507' ' ' PRO . 65.9 m-85 -110.45 -61.38 1.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.249 -175.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.566 HD22 HD23 ' B' ' 515' ' ' LEU . 74.7 mt -96.93 -14.79 21.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.807 -0.179 . . . . 0.0 111.474 -174.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.8 -19.04 64.9 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.668 -176.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -85.73 -3.81 59.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.694 0.283 . . . . 0.0 110.812 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.431 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 74.0 m-85 -122.98 95.11 46.57 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.69 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 8.2 Cg_endo -51.24 -50.75 12.92 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.21 2.606 . . . . 0.0 113.1 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.73 -39.17 87.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.9 0.381 . . . . 0.0 111.577 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.566 HD23 HD22 ' B' ' 509' ' ' LEU . 14.6 tp -78.13 -41.38 35.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 -173.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -66.96 -39.25 87.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.681 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.84 -36.19 83.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.567 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 8.7 t90 -59.4 -49.03 79.37 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.438 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.3 OUTLIER -62.48 -42.66 99.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.627 -177.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -61.96 -40.15 94.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.793 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -63.42 -47.61 81.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.049 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.91 -35.18 79.92 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.01 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.52 -9.23 58.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.657 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.08 41.18 61.04 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.203 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.8 t80 . . . . . 0 C--N 1.322 -0.593 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.887 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 37.7 m . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.439 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 2.6 Cg_exo -75.61 163.37 34.1 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.543 2.162 . . . . 0.0 111.829 176.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -114.78 154.23 28.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.472 -178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.759 HG13 HD22 ' B' ' 483' ' ' ASN . 3.7 p -112.17 135.61 50.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.365 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -101.15 133.65 45.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.155 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.416 HD12 HG13 ' A' ' 182' ' ' VAL . 64.7 mt -114.82 3.31 14.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.65 0.738 . . . . 0.0 110.117 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -28.76 40.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.43 -0.804 . . . . 0.0 108.956 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.422 ' HG3' ' N ' ' A' ' 153' ' ' LEU . 3.7 pt20 -59.13 -32.05 69.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.475 175.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.555 HD12 HD22 ' B' ' 504' ' ' LEU . 69.3 mt -69.23 166.83 17.57 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.399 0.619 . . . . 0.0 112.186 -172.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -73.57 163.95 27.32 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.406 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.43 -44.8 76.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.278 0.561 . . . . 0.0 109.842 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -64.83 -31.3 72.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.165 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.4 m -60.55 -45.73 92.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.17 0.51 . . . . 0.0 110.797 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.662 HD13 ' HZ2' ' A' ' 175' ' ' LYS . 87.4 mt -68.91 -38.56 79.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.791 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -63.05 -40.39 97.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.512 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -64.08 -41.58 97.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.272 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.524 ' HH ' HD11 ' A' ' 189' ' ' ILE . 62.6 t80 -54.02 -52.29 61.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.762 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.964 ' HZ2' HG23 ' A' ' 181' ' ' ILE . 22.5 mtpp -67.19 -28.13 67.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.207 -175.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -78.22 -42.57 30.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.681 0.277 . . . . 0.0 111.148 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -77.43 -36.78 52.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.687 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.494 ' CE1' HG21 ' B' ' 490' ' ' ILE . 43.7 m-85 -83.72 -4.21 58.42 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.337 178.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 59.03 78.77 0.25 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.625 0.578 . . . . 0.0 111.174 178.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.582 HD12 ' HG2' ' A' ' 162' ' ' LYS . 92.5 mt -115.71 113.19 42.58 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.06 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 15.9 Cg_exo -68.07 135.92 36.27 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.647 2.898 . . . . 0.0 112.057 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 3.7 t . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.652 -177.121 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 86.5 mt . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.854 0.359 . . . . 0.0 110.56 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.434 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 88.4 m-20 -113.59 178.03 4.42 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.256 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.687 ' O ' HG21 ' A' ' 179' ' ' VAL . 55.4 tptt -46.05 -57.91 4.05 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.879 0.737 . . . . 0.0 112.166 -177.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . 0.539 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -54.52 -49.63 69.76 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -176.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.1 -43.02 91.84 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.017 0.437 . . . . 0.0 110.594 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 94.8 mt -61.81 -48.85 78.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.022 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.687 HG21 ' O ' ' A' ' 175' ' ' LYS . 13.6 t -58.66 -42.6 85.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.501 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 19.3 mm-40 -58.28 -49.74 76.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.651 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.964 HG23 ' HZ2' ' A' ' 162' ' ' LYS . 79.6 mt -65.4 -48.48 82.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.068 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.561 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.1 t -59.28 -45.76 92.88 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.959 -177.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.16 -39.91 94.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.374 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.4 t -59.22 -40.49 86.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.755 0.312 . . . . 0.0 110.726 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -87.25 -26.43 23.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.776 0.322 . . . . 0.0 111.089 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.561 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 27.4 t80 -60.9 -44.02 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.008 0.523 . . . . 0.0 111.136 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . 0.551 ' HB3' ' HZ2' ' A' ' 187' ' ' LYS . 8.1 mtpm? -79.94 21.64 0.55 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.06 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 45.5 m -145.77 28.75 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.816 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.623 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 73.2 mt -90.1 125.38 60.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.666 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.47 140.3 51.97 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.837 2.358 . . . . 0.0 110.973 172.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.495 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.0 p -153.05 134.74 5.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.16 0.505 . . . . 0.0 110.925 -174.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -102.78 109.17 20.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 40.1 tt0 -47.89 -62.56 1.4 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -169.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -65.37 -45.13 85.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.504 0.192 . . . . 0.0 111.494 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.68 -43.26 99.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.601 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 89.7 m -65.2 -37.16 86.44 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.039 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 22.1 mt -60.99 -47.27 87.23 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.4 m -59.17 -46.06 89.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.354 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 69.3 m -61.15 -51.22 69.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.346 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.589 ' CD1' HD23 ' B' ' 488' ' ' LEU . 45.8 t80 -56.24 -55.99 26.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.291 -178.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.588 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 74.9 mt -55.72 -48.86 77.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.21 -42.07 98.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.845 -177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.4 m -62.95 -42.77 99.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.414 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 200' ' ' PHE . 56.6 t -68.84 -28.09 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.04 0.448 . . . . 0.0 110.736 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.588 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 14.2 mmm-85 . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.538 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 463' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 120.807 0.337 . . . . 0.0 111.707 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.459 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.1 mp0 -63.33 -40.84 98.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.127 177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.1 m -68.06 -29.84 68.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.229 176.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.419 ' HB3' ' O ' ' B' ' 463' ' ' THR . 54.4 tp -64.91 -46.22 82.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.745 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.8 t80 -52.59 -58.88 5.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.61 175.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.485 ' HE2' HD12 ' A' ' 201' ' ' ILE . 59.3 m-85 -62.62 -32.07 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.76 -45.27 90.58 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.032 0.444 . . . . 0.0 110.393 176.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -63.39 -43.44 97.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.421 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.0 t -57.63 -43.72 84.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.068 0.461 . . . . 0.0 110.444 177.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -56.74 -50.9 70.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.552 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -77.29 -24.59 50.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.607 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -78.45 -42.1 30.89 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.71 -44.94 22.36 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.998 -177.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 70.06 -55.49 0.6 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.912 0.757 . . . . 0.0 111.927 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 8.8 t -63.74 125.97 26.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.438 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.62 -46.16 84.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.312 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -31.27 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.36 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.439 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -72.86 -41.87 64.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.988 0.423 . . . . 0.0 110.942 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.54 -37.54 77.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.246 0.546 . . . . 0.0 109.748 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.672 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 28.8 tt0 -64.29 -38.57 91.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.405 175.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.759 HD22 HG13 ' A' ' 148' ' ' VAL . 25.4 t-20 -58.03 -44.57 87.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.873 176.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -55.98 -45.79 78.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.166 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.495 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.7 mt -67.79 -29.13 68.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.227 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.672 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -62.99 -43.19 99.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.918 0.389 . . . . 0.0 110.101 173.62 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.63 -35.82 78.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.266 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.589 HD23 ' CD1' ' A' ' 200' ' ' PHE . 25.0 mt -66.52 -52.08 49.72 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.265 179.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 11.2 m -61.06 -41.91 91.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.561 HD12 ' HE1' ' A' ' 186' ' ' PHE . 18.7 pt -69.7 -27.49 33.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.838 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -67.89 -39.1 83.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 109.841 172.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . 0.496 HD22 ' HA ' ' A' ' 200' ' ' PHE . 14.8 m120 -72.48 -35.28 68.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.261 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.06 18.65 3.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.528 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 56.26 49.11 15.89 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.162 0.506 . . . . 0.0 111.463 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 75.7 t -103.43 -49.26 10.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.582 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.448 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 44.8 pt -112.24 172.16 3.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.917 0.389 . . . . 0.0 110.966 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 18.9 p -109.43 179.73 4.06 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.786 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.516 ' O ' HG21 ' B' ' 502' ' ' VAL . 57.9 ttp180 -59.85 -47.83 84.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.775 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.76 70.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.784 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.462 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.4 mm-40 -56.36 -46.03 80.2 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.158 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.413 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 63.6 tp -58.31 -48.62 79.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.43 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.538 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 67.1 t -65.65 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.16 -177.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.413 HE21 ' HB2' ' B' ' 503' ' ' GLN . 16.2 mt-30 -77.04 -30.69 55.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -176.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.555 HD22 HD12 ' A' ' 153' ' ' LEU . 44.3 mt -66.73 -41.62 87.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.984 0.421 . . . . 0.0 111.78 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -86.94 10.41 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.353 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.68 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 78.2 p -64.77 -44.2 72.18 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.68 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 24.1 Cg_exo -67.46 -8.53 22.45 Favored 'Trans proline' 0 C--N 1.358 1.068 0 C-N-CA 122.086 1.858 . . . . 0.0 111.977 176.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -99.92 -67.9 0.83 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.753 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.601 HD22 HD21 ' B' ' 515' ' ' LEU . 67.0 mt -96.22 -8.1 33.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.438 -173.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.68 -16.31 61.01 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 121.093 -0.575 . . . . 0.0 113.043 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.587 ' HE3' ' O ' ' B' ' 507' ' ' PRO . 0.0 OUTLIER -87.76 -2.91 58.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.932 0.396 . . . . 0.0 110.518 178.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -117.77 96.78 50.02 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.732 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.52 -52.5 8.75 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.195 2.596 . . . . 0.0 112.879 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.21 -39.82 87.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.905 0.383 . . . . 0.0 111.461 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.601 HD21 HD22 ' B' ' 509' ' ' LEU . 25.4 tp -79.8 -44.1 21.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.957 -172.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.405 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 8.7 t80 -69.02 -32.98 72.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.284 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -73.77 -35.37 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.125 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.459 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 11.5 t90 -56.38 -48.82 76.08 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 173.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.538 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 21.6 t80 -55.92 -45.93 78.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.678 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 99.0 mttt -59.71 -47.93 83.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.107 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -62.21 -41.92 98.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -177.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -64.75 -35.54 81.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.052 0.453 . . . . 0.0 110.694 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.48 -7.15 57.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.172 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 68.41 26.82 74.09 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.969 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 85.4 t80 . . . . . 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 110.531 -176.278 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 97.9 m . . . . . 0 C--O 1.233 0.186 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.17 143.03 82.76 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.241 1.96 . . . . 0.0 111.748 176.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -98.66 118.99 36.62 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.148 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.0 p -81.97 123.66 38.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.304 0.574 . . . . 0.0 110.792 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -89.39 131.26 35.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.177 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.448 HD13 HG12 ' A' ' 182' ' ' VAL . 96.8 mt -111.21 6.38 20.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.242 0.544 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -81.66 -26.73 34.51 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.55 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 28.0 pt20 -67.79 -22.51 65.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.578 175.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.519 HD21 HD23 ' B' ' 504' ' ' LEU . 30.8 mt -67.26 151.14 48.04 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . 0.49 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 50.9 mt-30 -63.83 148.46 49.26 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.497 HG12 ' HE ' ' A' ' 159' ' ' ARG . 48.3 t -56.96 -46.85 84.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.199 0.523 . . . . 0.0 109.892 178.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.17 -33.42 74.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.606 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.732 HG21 ' HG2' ' B' ' 500' ' ' GLU . 25.8 m -64.42 -45.67 86.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.897 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.576 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.6 mt -64.25 -37.32 87.05 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 110.519 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.497 ' HE ' HG12 ' A' ' 155' ' ' VAL . 74.2 mtt-85 -67.68 -38.13 83.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.53 176.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.562 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.6 ttm180 -65.2 -42.88 93.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.061 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.428 ' OH ' HD11 ' A' ' 189' ' ' ILE . 58.0 t80 -53.3 -47.81 68.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.916 173.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.764 ' HZ1' ' HB ' ' A' ' 181' ' ' ILE . 43.6 mttp -61.33 -49.43 77.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.823 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -63.79 -48.1 78.24 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -65.66 -41.77 92.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.91 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -87.0 3.22 46.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.666 -178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 55.74 60.58 3.22 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.043 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 162' ' ' LYS . 85.9 mt -94.45 130.7 32.91 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.957 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.33 125.24 15.85 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.163 1.909 . . . . 0.0 111.423 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 3.2 p . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.938 -177.052 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 90.9 mt . . . . . 0 C--O 1.233 0.21 0 CA-C-O 121.042 0.449 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.487 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 6.2 m-20 -104.21 164.74 11.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.529 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.431 ' HE2' HG21 ' A' ' 155' ' ' VAL . 5.8 tmtt? -56.33 -50.08 72.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.667 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.95 85.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.42 ' HA ' ' HG2' ' A' ' 180' ' ' GLU . 10.2 mm-40 -61.63 -41.71 97.87 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.555 0.693 . . . . 0.0 110.249 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.576 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 98.7 mt -61.85 -52.06 65.69 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.883 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.444 HG13 ' HB2' ' A' ' 150' ' ' LEU . 78.5 t -58.24 -48.99 83.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 O-C-N 123.614 0.571 . . . . 0.0 111.626 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.548 ' HG3' ' N ' ' A' ' 181' ' ' ILE . 6.7 pt-20 -62.02 -46.19 90.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.44 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.764 ' HB ' ' HZ1' ' A' ' 162' ' ' LYS . 80.6 mt -70.95 -39.27 74.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 120.622 0.249 . . . . 0.0 110.916 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 54.6 t -64.66 -47.55 88.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.94 -41.16 98.77 Favored Glycine 0 N--CA 1.449 -0.482 0 O-C-N 123.454 0.471 . . . . 0.0 112.432 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.7 t -59.19 -45.14 91.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.891 0.377 . . . . 0.0 110.544 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -78.27 -29.76 48.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.565 ' HE1' HD11 ' B' ' 490' ' ' ILE . 15.3 t80 -60.83 -39.02 87.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.683 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -75.78 6.6 4.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 p -128.88 21.09 5.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.922 0.392 . . . . 0.0 111.248 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.703 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.3 mt -88.85 118.35 69.2 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.417 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -78.22 137.74 15.44 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.003 2.469 . . . . 0.0 111.569 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.531 HG12 ' HB3' ' B' ' 485' ' ' LEU . 0.0 OUTLIER -124.77 167.18 19.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.21 0.528 . . . . 0.0 111.786 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -125.28 110.38 13.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.684 174.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -48.36 -59.82 3.16 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.392 0.433 . . . . 0.0 111.766 -172.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -55.55 -57.37 12.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.68 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.43 -48.37 79.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.602 -173.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.1 m -63.59 -41.14 98.38 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.541 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 68.8 mt -65.17 -43.22 92.42 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.193 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.1 m -59.26 -41.09 87.98 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.699 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 91.7 m -58.36 -55.99 27.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 176.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.519 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 60.6 t80 -57.53 -50.81 71.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.399 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.465 HD13 ' HE2' ' B' ' 468' ' ' PHE . 63.9 mt -57.36 -55.13 22.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.766 -175.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.48 -32.74 70.39 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.0 m -70.45 -45.97 64.73 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.218 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.1 -27.96 20.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.974 0.416 . . . . 0.0 111.158 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.188 177.543 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.497 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.452 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.6 mp0 -58.56 -43.77 89.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.598 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 6.8 m -59.29 -44.07 92.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.028 0.442 . . . . 0.0 110.441 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.08 -49.83 76.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.815 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.4 t80 -53.03 -55.87 20.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.6 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.519 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 29.9 m-85 -63.92 -34.25 77.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.42 -43.65 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.542 -0.463 . . . . 0.0 109.985 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.56 -45.28 93.64 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 175.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.513 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -57.31 -49.41 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.987 0.422 . . . . 0.0 110.383 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -62.68 -38.41 90.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.838 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 tptp -80.35 -33.01 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.521 -174.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -80.56 -46.25 16.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.319 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.1 -46.66 87.73 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.7 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 51.1 mtt85 71.55 -49.24 0.68 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.74 0.65 . . . . 0.0 112.705 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.0 t -66.21 129.45 39.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.711 -178.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.34 70.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.727 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -75.55 -22.5 56.99 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.835 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -66.28 -51.41 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.133 0.492 . . . . 0.0 110.117 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.479 ' CE2' HD11 ' B' ' 485' ' ' LEU . 90.5 t80 -63.37 -40.64 97.8 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.945 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.553 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 38.1 tt0 -60.76 -42.78 98.11 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.865 177.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.415 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 6.9 t30 -59.38 -39.9 84.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.6 -45.95 81.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.389 0.614 . . . . 0.0 109.915 172.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.531 ' HB3' HG12 ' A' ' 191' ' ' VAL . 83.5 mt -67.02 -33.19 75.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.362 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.703 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.0 OUTLIER -57.75 -45.79 85.41 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.224 0.535 . . . . 0.0 109.867 174.132 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 36.4 m -59.69 -38.93 82.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.401 176.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . . . . . . . . . 39.9 mt -65.34 -49.31 69.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 10.8 m -63.76 -42.89 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.665 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.565 HD11 ' HE1' ' A' ' 186' ' ' PHE . 26.5 pt -69.89 -28.53 37.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.874 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -67.61 -43.05 81.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.172 0.511 . . . . 0.0 110.344 174.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -79.49 -16.21 56.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.791 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -98.64 21.26 11.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.361 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 65.84 25.74 11.23 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.404 0.44 . . . . 0.0 112.103 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.562 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 89.2 t -92.25 -56.19 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.755 0.312 . . . . 0.0 110.663 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.431 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 32.8 pt -111.04 162.48 8.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.726 0.298 . . . . 0.0 110.289 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 8.9 t -105.82 -175.24 2.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.13 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.527 ' O ' HG22 ' B' ' 502' ' ' VAL . 37.3 ttm180 -55.85 -51.65 66.77 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.677 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -50.46 -50.81 51.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.892 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.732 ' HG2' HG21 ' A' ' 157' ' ' THR . 3.8 mp0 -60.47 -45.17 94.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.939 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.616 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 64.9 tp -57.32 -46.0 83.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.029 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.773 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 54.5 t -64.54 -38.01 81.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.954 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.55 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 48.6 mt-30 -71.37 -42.48 68.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.912 -177.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.519 HD23 HD21 ' A' ' 153' ' ' LEU . 76.5 mt -63.33 -40.86 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.565 HG23 ' HG ' ' B' ' 509' ' ' LEU . 6.7 p -86.63 4.49 3.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.982 0.42 . . . . 0.0 111.262 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.446 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 24.0 t -59.0 -52.44 74.77 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.751 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' B' ' 506' ' ' SER . 10.8 Cg_endo -57.75 -18.35 33.5 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 122.082 1.854 . . . . 0.0 113.154 176.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.71 -52.0 5.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.565 ' HG ' HG23 ' B' ' 505' ' ' VAL . 62.4 mt -97.71 -11.72 23.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.536 -174.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.56 -14.04 64.14 Favored Glycine 0 C--O 1.23 -0.136 0 C-N-CA 121.391 -0.433 . . . . 0.0 112.875 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 53.1 mttm -77.22 -15.51 59.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.271 0.557 . . . . 0.0 109.659 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -124.08 96.89 41.55 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.247 -176.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -49.58 -48.3 19.56 Favored 'Trans proline' 0 CA--C 1.529 0.253 0 C-N-CA 123.234 2.622 . . . . 0.0 113.504 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -66.94 -40.6 87.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.985 0.421 . . . . 0.0 111.088 -177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 18.5 tp -69.23 -44.84 71.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.523 -175.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -68.31 -32.88 73.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.087 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -63.5 -43.0 98.48 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.452 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 12.4 t90 -57.28 -49.06 77.26 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.846 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.773 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 66.9 t80 -59.04 -46.72 87.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.145 -178.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -64.17 -36.25 83.46 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.968 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -72.01 -37.42 69.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.108 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -66.87 -34.35 77.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.28 0.562 . . . . 0.0 110.583 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.48 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 9.0 mp -83.93 -14.65 50.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.038 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.97 35.82 61.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.139 -174.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 79.1 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.253 -0.473 . . . . 0.0 110.468 -177.657 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.9 m . . . . . 0 C--O 1.236 0.365 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -57.91 133.26 54.74 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.367 2.044 . . . . 0.0 111.296 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.42 110.09 6.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.302 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -73.7 110.36 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.582 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 18.9 t0 -72.38 88.15 1.18 Allowed 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.511 HD23 HD21 ' B' ' 504' ' ' LEU . 95.7 mt -89.57 -8.06 53.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.818 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -82.69 -23.06 34.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.865 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.582 ' NE2' ' HB3' ' A' ' 149' ' ' ASP . 27.5 pt20 -74.2 -18.94 60.69 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.86 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.3 mt -65.79 155.27 36.71 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.742 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -71.26 158.93 35.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.159 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 16.6 t -60.67 -46.32 96.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 109.972 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . 0.522 ' HA ' ' HB3' ' A' ' 159' ' ' ARG . 84.7 m-20 -67.71 -21.34 65.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.733 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.3 m -69.5 -51.32 36.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.183 0.516 . . . . 0.0 110.468 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 30.7 mt -65.96 -32.58 74.16 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 122.034 0.921 . . . . 0.0 109.57 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.522 ' HB3' ' HA ' ' A' ' 156' ' ' ASN . 77.8 ttt180 -63.08 -43.37 98.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.568 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 17.8 ttm180 -69.5 -37.73 77.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.543 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.497 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 70.9 t80 -51.53 -57.37 9.25 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.605 0.24 . . . . 0.0 110.7 174.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.664 ' HZ2' HD21 ' A' ' 178' ' ' LEU . 7.1 ptpp? -66.96 -27.02 67.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.794 0.33 . . . . 0.0 111.13 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -69.43 -47.95 62.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.777 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -71.93 -45.44 61.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.042 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.426 ' CZ ' HG23 ' B' ' 490' ' ' ILE . 70.8 m-85 -81.74 1.91 32.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.331 -177.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 57.4 74.47 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.25 176.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.651 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 90.0 mt -111.45 106.86 57.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.944 177.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.63 126.02 20.04 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.305 2.003 . . . . 0.0 111.39 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.634 ' HB ' HD11 ' A' ' 173' ' ' LEU . 3.1 p . . . . . 0 C--N 1.32 -0.698 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.125 -176.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.634 HD11 ' HB ' ' A' ' 169' ' ' THR . 95.8 mt . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 121.019 0.438 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.618 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 18.0 m120 -102.04 169.59 8.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.999 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.515 ' O ' HG21 ' A' ' 179' ' ' VAL . 22.5 tptm -59.87 -54.24 48.5 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.317 -178.142 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.79 -33.39 72.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.982 0.42 . . . . 0.0 110.66 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.618 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 15.6 mm100 -62.0 -45.06 95.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.304 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.664 HD21 ' HZ2' ' A' ' 162' ' ' LYS . 62.7 mt -59.14 -47.49 85.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.518 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.515 HG21 ' O ' ' A' ' 175' ' ' LYS . 18.3 t -59.29 -45.05 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.072 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -61.64 -46.13 91.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.17 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 86.8 mt -58.49 -45.84 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-O 121.165 0.507 . . . . 0.0 110.426 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.548 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 70.3 t -62.22 -48.63 87.52 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.991 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -65.02 -38.89 95.97 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.384 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 48.2 t -59.03 -43.29 91.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.801 0.334 . . . . 0.0 110.811 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -84.47 -23.23 29.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 110.951 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.574 ' HE1' HD11 ' B' ' 490' ' ' ILE . 20.7 t80 -64.41 -41.62 96.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.799 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -70.62 -18.35 62.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.677 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 14.9 p -106.5 27.41 8.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.608 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.9 mt -89.9 114.07 59.4 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.547 0.213 . . . . 0.0 110.448 175.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -68.49 103.92 1.03 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.436 2.091 . . . . 0.0 111.663 177.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.584 HG22 ' HB3' ' B' ' 485' ' ' LEU . 9.9 p -110.47 156.85 11.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -127.81 126.23 41.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.4 tt0 -50.9 -59.71 3.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.92 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.91 -57.16 13.83 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.62 -39.59 84.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 -171.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 95.6 m -67.58 -38.63 84.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.611 -178.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 39.6 mt -63.41 -46.11 87.9 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 174.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.6 m -59.09 -40.55 85.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.535 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 21.1 m -57.56 -55.79 30.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.248 177.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.55 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.5 t80 -62.09 -51.58 67.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.235 -175.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.55 -48.88 85.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.78 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -71.43 -31.2 66.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.081 -174.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.5 m -72.7 -53.97 10.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.198 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.47 HG12 HD22 ' B' ' 523' ' ' LEU . 54.4 t -65.29 -36.09 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.658 -174.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 111.079 177.18 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -64.16 -47.91 78.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.663 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.2 m -60.77 -35.11 75.61 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.241 177.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.419 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 35.9 tp -63.08 -52.33 63.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.153 176.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.491 ' O ' HG21 ' B' ' 471' ' ' VAL . 65.8 t80 -52.54 -57.89 8.53 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.95 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -64.39 -34.53 78.38 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.4 -40.63 96.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.252 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.1 mttt -68.27 -34.92 77.06 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.696 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.491 HG21 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -63.1 -42.92 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.073 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.24 92.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.441 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -74.35 -36.55 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.185 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.581 ' HB3' ' CE2' ' B' ' 512' ' ' PHE . . . -66.6 -48.95 67.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.69 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . 0.426 HD23 ' O ' ' B' ' 480' ' ' ALA . 10.3 mp -71.43 -37.15 71.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.026 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 71.89 -60.83 0.51 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 124.134 0.896 . . . . 0.0 112.642 170.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 45.4 m -67.51 139.45 56.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.945 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -58.03 -44.72 87.51 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.06 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -65.12 -39.11 92.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.557 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.426 ' O ' HD23 ' B' ' 475' ' ' LEU . . . -62.09 -51.57 67.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.871 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -65.84 -36.94 84.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.215 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.667 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 30.3 tt0 -59.44 -42.13 91.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 175.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.645 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.1 t30 -60.8 -43.29 98.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.98 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.8 -45.19 70.7 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.325 0.583 . . . . 0.0 110.359 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.584 ' HB3' HG22 ' A' ' 191' ' ' VAL . 86.2 mt -67.53 -31.81 72.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.466 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.667 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -63.39 -36.91 85.28 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.218 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.1 m -65.14 -36.2 83.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.897 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.55 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.3 mt -65.25 -48.55 72.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.337 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.4 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 13.9 m -65.04 -42.26 94.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.828 -177.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.574 HD11 ' HE1' ' A' ' 186' ' ' PHE . 38.7 pt -69.15 -30.74 47.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.169 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -68.37 -45.01 73.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.111 0.481 . . . . 0.0 110.242 173.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -62.24 -38.8 90.61 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.991 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 89.7 mt-30 -86.31 16.28 4.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.698 -176.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . 0.409 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 0.1 OUTLIER 63.08 38.95 10.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.985 0.421 . . . . 0.0 111.045 174.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.568 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.9 t -96.7 -33.71 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.255 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 39.0 pt -124.73 153.32 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.929 0.395 . . . . 0.0 111.212 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 46.2 m -80.02 166.23 21.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.019 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.498 ' O ' HG22 ' B' ' 502' ' ' VAL . 20.7 ttm180 -54.92 -53.98 48.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.765 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.56 85.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.823 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.543 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.0 mm-40 -55.48 -46.29 76.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.67 -51.12 71.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.038 0.447 . . . . 0.0 110.99 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.498 HG22 ' O ' ' B' ' 498' ' ' ARG . 59.9 t -60.09 -35.44 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.667 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -67.42 -42.25 83.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.91 178.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 93.8 mt -66.77 -39.91 88.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 111.508 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.419 HG13 ' CE2' ' B' ' 519' ' ' PHE . 4.6 p -85.14 2.43 4.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.035 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.698 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 14.2 t -58.49 -53.84 62.1 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.357 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.698 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 31.8 Cg_exo -61.83 -26.66 79.57 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.744 1.629 . . . . 0.0 112.143 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -73.93 -60.59 2.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.575 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.605 HD22 HD22 ' B' ' 515' ' ' LEU . 78.8 mt -102.28 -10.39 19.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -172.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.21 -21.76 64.43 Favored Glycine 0 C--O 1.229 -0.166 0 C-N-CA 121.229 -0.51 . . . . 0.0 113.312 -176.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -81.98 0.95 37.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.079 0.466 . . . . 0.0 110.79 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.581 ' CE2' ' HB3' ' B' ' 474' ' ' ALA . 50.2 m-85 -125.58 90.29 50.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 174.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 -45.7 27.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.484 2.79 . . . . 0.0 113.602 -174.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.29 -45.23 73.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.975 0.417 . . . . 0.0 110.659 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.605 HD22 HD22 ' B' ' 509' ' ' LEU . 15.5 tp -67.89 -43.13 80.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.635 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.452 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 25.8 t80 -67.29 -38.84 85.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.446 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.69 -37.78 85.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.491 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.61 -49.3 75.35 Favored 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.419 ' CE2' HG13 ' B' ' 505' ' ' VAL . 66.0 t80 -58.86 -45.9 89.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.859 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.418 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 58.3 mtpt -62.95 -42.71 99.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.874 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . 0.402 HD21 ' C ' ' B' ' 521' ' ' ASN . 0.2 OUTLIER -66.44 -35.5 80.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.988 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.21 -42.72 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.346 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.47 HD22 HG12 ' A' ' 204' ' ' VAL . 81.8 mt -78.21 -14.96 59.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.374 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 78.15 15.98 80.33 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.345 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 61.2 t80 . . . . . 0 C--N 1.325 -0.485 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.61 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.3 m . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -73.72 155.63 49.17 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.534 2.156 . . . . 0.0 111.159 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -123.02 145.93 48.09 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.772 0.32 . . . . 0.0 111.256 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.87 125.23 51.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.91 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.426 ' HB2' ' OE1' ' A' ' 152' ' ' GLN . 11.0 m-20 -72.96 -30.49 63.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.687 -174.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.404 HD23 HD23 ' B' ' 504' ' ' LEU . 64.8 mt 60.5 7.16 1.26 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.114 -176.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -75.14 -26.42 59.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.436 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.6 OUTLIER -61.59 -17.87 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.076 -177.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.595 ' O ' ' HB ' ' A' ' 157' ' ' THR . 28.1 mt -80.42 4.6 17.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . 0.628 HE21 ' HA ' ' A' ' 154' ' ' GLN . 0.0 OUTLIER 55.61 -170.79 0.07 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.782 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.589 HG11 HD11 ' A' ' 178' ' ' LEU . 1.6 m -77.85 -37.64 23.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 121.632 -0.667 . . . . 0.0 110.776 172.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -58.21 -53.69 55.43 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.595 ' HB ' ' O ' ' A' ' 153' ' ' LEU . 41.9 m -70.57 -34.68 72.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.641 0.258 . . . . 0.0 111.388 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.44 HD23 HD12 ' A' ' 153' ' ' LEU . 82.8 mt -63.06 -40.18 96.92 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.351 0.596 . . . . 0.0 110.523 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.2 mtt180 -69.88 -31.4 69.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.815 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 29.4 ttm180 -68.27 -42.37 79.65 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.497 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 52.8 t80 -52.05 -51.25 58.72 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 173.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.457 ' HZ3' ' HB ' ' A' ' 181' ' ' ILE . 54.4 mttp -61.01 -43.65 98.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.745 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -70.38 -38.87 74.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.29 -175.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -79.53 -35.52 39.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -176.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.423 ' CZ ' HG23 ' B' ' 490' ' ' ILE . 59.3 m-85 -92.75 1.69 57.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 59.34 79.89 0.21 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.804 0.69 . . . . 0.0 111.38 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 96.8 mt -120.17 100.37 47.93 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.92 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -61.59 125.65 17.23 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.382 2.055 . . . . 0.0 111.657 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.883 -175.694 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.073 0.463 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.563 ' HB3' ' HG2' ' A' ' 177' ' ' GLN . 56.5 t30 -142.0 165.5 27.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.257 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 154' ' ' GLN . 27.2 tptp -50.22 -54.85 18.14 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 122.84 0.456 . . . . 0.0 111.546 -178.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.49 93.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.332 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.563 ' HG2' ' HB3' ' A' ' 174' ' ' ASN . 8.6 mm100 -64.42 -38.56 91.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.54 0.686 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.589 HD11 HG11 ' A' ' 155' ' ' VAL . 96.6 mt -61.9 -44.86 95.93 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.929 176.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.27 -50.34 80.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 O-C-N 123.58 0.55 . . . . 0.0 111.36 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -56.41 -53.71 54.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.619 0.247 . . . . 0.0 111.476 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.457 ' HB ' ' HZ3' ' A' ' 162' ' ' LYS . 64.1 mt -62.63 -40.71 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-O 120.714 0.292 . . . . 0.0 111.036 -178.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.435 HG21 ' NZ ' ' A' ' 162' ' ' LYS . 39.2 t -64.64 -47.82 87.32 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.22 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.32 -36.28 92.84 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.349 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.2 t -58.63 -47.4 84.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.317 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -80.13 -28.44 38.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.497 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 59.5 t80 -61.0 -47.68 85.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.137 -177.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . 0.627 ' HB3' ' HZ2' ' A' ' 187' ' ' LYS . 7.6 mtpm? -74.53 -3.66 32.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -106.94 17.29 23.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.991 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.657 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.4 mt -87.98 117.74 68.82 Favored Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.881 178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -74.64 100.07 1.29 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.863 2.375 . . . . 0.0 111.0 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.425 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 13.3 p -115.46 135.2 56.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.061 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -108.05 125.72 51.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.027 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.0 tt0 -50.97 -59.71 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 123.63 0.581 . . . . 0.0 112.39 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -51.8 -58.21 7.09 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.656 0.614 . . . . 0.0 112.656 -173.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.02 -41.5 97.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.084 -176.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 54.7 m -65.92 -42.85 89.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 201' ' ' ILE . 53.1 mt -59.46 -43.84 93.11 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 41.8 m -59.5 -48.41 81.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.771 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.96 -49.15 78.94 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.788 0.328 . . . . 0.0 110.626 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.659 ' CD1' HD21 ' B' ' 488' ' ' LEU . 46.2 t80 -59.35 -60.39 3.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.699 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 197' ' ' LEU . 46.9 mt -58.11 -44.7 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.002 0.43 . . . . 0.0 110.497 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -61.87 -41.21 97.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.966 -178.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -63.56 -51.67 64.39 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.801 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.3 t -65.69 -28.8 45.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.226 -175.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 . . . . . 0 C--O 1.234 0.256 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.615 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.8 p . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.062 0.458 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.16 -42.84 91.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.791 176.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 5.8 t -64.15 -35.74 81.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.284 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.36 -44.44 96.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.099 177.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.537 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.3 t80 -53.24 -55.02 27.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.463 ' HE2' HD12 ' A' ' 201' ' ' ILE . 63.5 m-85 -65.49 -32.35 73.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.13 -40.51 97.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.531 . . . . 0.0 110.253 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -68.19 -44.12 76.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.537 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.537 HG23 ' O ' ' B' ' 467' ' ' PHE . 59.8 t -55.12 -43.64 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.188 0.518 . . . . 0.0 110.052 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 28.9 mtt-85 -57.09 -53.0 63.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.799 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -73.28 -33.63 65.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.729 -174.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.565 ' HB3' ' CE2' ' B' ' 512' ' ' PHE . . . -73.62 -47.93 36.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.773 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . 0.429 ' C ' ' H ' ' B' ' 477' ' ' SER . 9.8 mp -69.26 -34.45 74.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.791 -178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 71.65 -40.54 0.48 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.937 0.773 . . . . 0.0 112.298 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 477' ' ' SER . . . . . 0.429 ' H ' ' C ' ' B' ' 475' ' ' LEU . 22.8 t -83.97 127.98 34.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.829 0.347 . . . . 0.0 110.387 -175.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.93 -46.51 84.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.664 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.21 -24.91 61.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.07 -176.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.86 -42.02 81.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.129 0.49 . . . . 0.0 109.826 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -66.69 -35.58 80.48 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 41.6 tt0 -62.52 -43.07 99.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.231 175.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.3 -45.87 72.66 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.628 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.548 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 82.3 t80 -54.98 -49.05 72.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.3 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 193' ' ' GLU . 89.1 mt -63.94 -34.47 78.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.548 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.657 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.5 mtt180 -67.66 -36.8 81.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.101 0.477 . . . . 0.0 110.349 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.53 -34.03 76.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.707 174.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.659 HD21 ' CD1' ' A' ' 200' ' ' PHE . 50.5 mt -68.04 -44.2 76.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.412 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.433 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.8 m -66.72 -42.87 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.401 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.423 HG23 ' CZ ' ' A' ' 165' ' ' PHE . 19.3 pt -69.66 -26.79 31.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.752 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -67.88 -39.33 83.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.102 0.477 . . . . 0.0 110.149 173.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -71.69 -26.12 62.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.965 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -93.6 18.07 10.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 64.78 14.58 9.25 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.562 0.538 . . . . 0.0 111.762 176.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.533 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 62.0 t -76.37 -41.5 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.852 0.358 . . . . 0.0 110.355 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.437 HG23 ' CG2' ' A' ' 157' ' ' THR . 37.1 pt -122.39 169.63 13.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.975 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 9.0 t -121.01 -176.0 3.17 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.592 ' HG3' ' HB3' ' B' ' 523' ' ' LEU . 22.9 ttm180 -57.53 -48.13 80.13 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.164 0.29 . . . . 0.0 111.639 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -56.79 -54.55 45.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.742 -174.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 1.7 pm0 -69.69 -32.49 71.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.522 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 61.5 tp -58.32 -49.71 76.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.798 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 99.3 t -64.07 -39.81 86.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.676 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.436 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 98.4 mt-30 -71.3 -24.96 62.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.093 -178.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 79.7 mt -70.46 -40.46 73.7 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.154 -0.341 . . . . 0.0 111.233 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.504 HG21 ' HG ' ' B' ' 509' ' ' LEU . 6.5 p -91.16 5.33 5.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 110.552 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.555 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 9.5 t -58.41 -48.64 96.59 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.345 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.7 Cg_exo -61.93 -9.3 13.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 122.353 2.036 . . . . 0.0 112.998 176.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -107.25 -60.03 1.74 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.252 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.504 ' HG ' HG21 ' B' ' 505' ' ' VAL . 82.6 mt -90.25 -12.75 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.943 -175.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -68.03 -7.07 48.82 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.706 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 52.1 mttm -84.92 -17.35 38.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.236 0.541 . . . . 0.0 109.739 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.565 ' CE2' ' HB3' ' B' ' 474' ' ' ALA . 51.2 m-85 -122.48 97.93 44.23 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.136 -175.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.6 -52.18 9.46 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 123.437 2.758 . . . . 0.0 113.596 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -66.85 -30.78 71.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 111.3 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 29.6 tp -78.09 -43.78 28.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.189 0.519 . . . . 0.0 109.988 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 9.2 t80 -67.8 -31.86 72.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.719 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -66.86 -42.92 84.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.794 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -54.18 -49.79 68.51 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.798 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 73.5 t80 -58.78 -59.48 5.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.87 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -57.0 -40.21 76.17 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -176.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -62.84 -37.7 87.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.937 0.399 . . . . 0.0 110.653 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -67.83 -47.23 69.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.902 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.592 ' HB3' ' HG3' ' B' ' 498' ' ' ARG . 3.8 mm? -70.57 -17.4 62.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.887 -177.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.91 32.59 12.44 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.382 -175.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 21.3 t80 . . . . . 0 C--N 1.324 -0.542 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.835 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 98.9 m . . . . . 0 C--O 1.234 0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.462 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 26.7 Cg_exo -62.32 136.49 60.0 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.444 2.096 . . . . 0.0 111.285 177.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -95.86 133.67 39.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.245 0.545 . . . . 0.0 111.856 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 p -92.75 102.97 14.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.457 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.61 117.93 13.79 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.54 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.45 1.9 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.13 0.49 . . . . 0.0 110.764 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -80.37 -26.99 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.729 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.609 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 6.1 pt20 -67.45 -20.91 65.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.153 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.563 HD12 HD21 ' B' ' 504' ' ' LEU . 73.0 mt -72.11 165.81 23.58 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.368 0.604 . . . . 0.0 112.182 -174.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . 0.546 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 23.0 mt-30 -72.2 154.15 41.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.552 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.1 t -63.12 -46.01 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.029 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -61.48 -33.15 73.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.631 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 48.2 m -61.93 -50.92 70.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.012 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.3 -39.4 93.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.126 0.489 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -67.96 -30.39 69.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.765 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.553 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.9 ttm180 -70.4 -40.86 73.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.582 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 61.6 t80 -57.03 -52.25 66.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.27 173.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.889 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 9.2 mtpm? -59.63 -33.62 71.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.992 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -78.19 -42.96 29.89 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.769 0.319 . . . . 0.0 111.232 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -67.07 -42.42 84.74 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -178.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -92.47 -1.38 57.02 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm 58.2 79.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.504 0.503 . . . . 0.0 111.597 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.703 HD22 HG22 ' A' ' 181' ' ' ILE . 11.0 mp -103.27 120.02 53.33 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.76 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 12.9 Cg_exo -68.97 129.71 18.94 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 123.572 2.848 . . . . 0.0 112.464 -175.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.547 ' CG2' ' HZ2' ' A' ' 162' ' ' LYS . 8.9 t . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.925 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.46 HD13 HG22 ' A' ' 169' ' ' THR . 81.9 mt . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.622 0.248 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.443 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 31.5 m-80 -85.43 177.9 7.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.612 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.618 ' O ' HG22 ' A' ' 179' ' ' VAL . 22.9 tptm -57.8 -52.59 64.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.388 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.8 -40.26 79.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 111.159 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -59.56 -48.02 83.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.332 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 91.2 mt -60.49 -48.71 80.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.138 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 175' ' ' LYS . 23.2 t -58.8 -46.68 90.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.302 -175.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.29 -39.32 82.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 -177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.703 HG22 HD22 ' A' ' 167' ' ' LEU . 70.7 mt -67.78 -47.34 80.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 120.805 0.336 . . . . 0.0 110.748 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.62 -47.29 85.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.78 -36.07 92.2 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.563 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 25.0 t -62.58 -39.54 94.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.853 0.359 . . . . 0.0 110.683 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -85.86 -31.75 22.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.765 0.317 . . . . 0.0 110.995 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.582 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 69.1 t80 -63.54 -40.54 97.3 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.843 0.457 . . . . 0.0 112.131 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -74.41 -6.55 48.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 111.55 -177.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 62.8 m -111.89 23.38 13.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.866 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 76.0 mt -84.17 116.04 63.01 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.672 0.272 . . . . 0.0 110.953 177.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 6.2 Cg_exo -74.41 105.59 2.08 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.073 2.516 . . . . 0.0 110.751 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.421 HG23 ' HB3' ' B' ' 485' ' ' LEU . 9.8 p -108.65 143.43 18.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.895 0.378 . . . . 0.0 111.368 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -110.78 113.24 25.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.943 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 47.7 tt0 -46.01 -60.28 2.36 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -60.17 -53.68 54.8 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -63.96 -39.51 94.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.884 0.373 . . . . 0.0 110.834 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 75.4 m -64.74 -43.73 92.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 -178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 63.6 mt -60.82 -45.06 95.9 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -56.91 -47.0 81.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.675 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 83.2 m -61.09 -50.78 71.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.417 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.581 ' CD1' HD21 ' B' ' 488' ' ' LEU . 87.1 t80 -60.93 -49.71 76.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.081 -177.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.455 HD11 ' HE2' ' B' ' 468' ' ' PHE . 83.9 mt -57.71 -49.95 79.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.382 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -63.27 -33.11 74.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.419 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 42.4 m -69.2 -53.21 21.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.709 0.29 . . . . 0.0 110.715 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 200' ' ' PHE . 15.2 t -66.72 -25.42 34.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.787 0.327 . . . . 0.0 110.987 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 205' ' ' ARG . 18.5 mtp180 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.567 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 463' ' ' THR . . . . . 0.461 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 2.8 p . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.463 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -68.28 -42.82 78.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.221 177.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -64.39 -35.53 81.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.022 0.439 . . . . 0.0 110.071 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' B' ' 463' ' ' THR . 18.8 tp -55.13 -53.51 55.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.915 174.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.527 ' CE1' ' HG ' ' B' ' 515' ' ' LEU . 79.4 t80 -54.15 -52.24 61.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.049 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.455 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.1 m-85 -64.79 -34.99 79.66 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.95 -43.12 93.77 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.33 0.586 . . . . 0.0 109.9 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.97 -45.6 94.11 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.146 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.485 HG21 ' O ' ' B' ' 467' ' ' PHE . 94.0 t -58.89 -40.57 80.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.533 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -54.07 -48.28 70.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.262 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . 0.508 ' O ' ' HG3' ' B' ' 476' ' ' ARG . 81.8 tttt -82.94 -35.02 26.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -178.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -66.71 -49.2 66.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.6 mp -67.47 -34.05 76.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.481 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' B' ' 473' ' ' LYS . 38.4 mtm180 69.0 -58.1 0.5 Allowed 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.968 0.792 . . . . 0.0 112.377 176.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.0 t -67.54 129.96 41.55 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.849 0.357 . . . . 0.0 110.191 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.22 71.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.496 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.47 -36.62 74.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.111 0.482 . . . . 0.0 109.871 176.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.462 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.41 -45.73 78.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.4 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.402 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 70.5 t80 -65.29 -39.5 92.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.105 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 36.8 tt0 -59.25 -42.68 91.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.243 175.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.62 -43.05 99.57 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -56.4 -45.88 80.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 174.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.421 ' HB3' HG23 ' A' ' 191' ' ' VAL . 93.1 mt -66.12 -33.37 75.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.927 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.866 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 10.7 mtt85 -66.52 -36.7 83.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.052 0.453 . . . . 0.0 110.178 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.2 m -61.21 -37.24 82.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.119 0.485 . . . . 0.0 109.776 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.581 HD21 ' CD1' ' A' ' 200' ' ' PHE . 38.6 mt -64.92 -46.99 79.36 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.473 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 486' ' ' ARG . 17.1 m -64.18 -41.26 91.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.562 -178.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 30.0 pt -69.42 -34.92 64.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.209 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . 0.629 ' HB2' HD22 ' B' ' 501' ' ' LEU . 90.0 t80 -61.65 -47.08 87.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.157 0.503 . . . . 0.0 109.846 172.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -61.38 -35.11 76.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.547 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -87.59 13.98 9.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.512 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.87 24.12 14.37 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 111.121 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 78.4 t -76.43 -39.11 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.644 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.596 HD12 HD23 ' B' ' 501' ' ' LEU . 30.9 pt -132.26 158.94 43.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.205 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 3.6 p -94.69 -178.3 4.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.814 0.34 . . . . 0.0 111.792 -176.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.475 ' O ' HG22 ' B' ' 502' ' ' VAL . 41.4 ttp180 -55.67 -55.09 36.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.735 -175.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . 0.505 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -58.67 -39.93 82.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.5 -176.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.61 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.805 0.336 . . . . 0.0 110.385 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.649 HD11 ' CZ ' ' B' ' 519' ' ' PHE . 0.2 OUTLIER -59.09 -50.58 73.52 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.542 0.687 . . . . 0.0 109.747 177.877 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.475 HG22 ' O ' ' B' ' 498' ' ' ARG . 58.0 t -60.64 -35.19 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.704 -1.135 . . . . 0.0 111.097 -177.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.609 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 75.9 mt-30 -79.15 -35.8 41.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.675 -178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.563 HD21 HD12 ' A' ' 153' ' ' LEU . 67.3 mt -68.19 -38.62 82.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.876 0.37 . . . . 0.0 111.44 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.533 HG21 ' HG ' ' B' ' 509' ' ' LEU . 5.6 p -86.26 1.43 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.126 0.489 . . . . 0.0 110.877 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.556 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.2 t -60.54 -47.74 95.38 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.813 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.564 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 32.4 Cg_exo -62.24 -7.08 9.37 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.285 1.99 . . . . 0.0 112.715 175.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -104.15 -58.25 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.833 0.349 . . . . 0.0 110.766 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.533 ' HG ' HG21 ' B' ' 505' ' ' VAL . 80.9 mt -88.49 -2.06 58.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.497 -174.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -65.83 -18.05 65.88 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.08 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.564 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 2.5 mptp? -92.21 -2.94 56.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.252 0.549 . . . . 0.0 109.645 178.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -127.55 85.25 61.28 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.853 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.16 -44.51 45.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.174 2.583 . . . . 0.0 112.927 -175.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.63 -46.27 89.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.024 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.527 ' HG ' ' CE1' ' B' ' 467' ' ' PHE . 2.2 tp -69.86 -40.73 75.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.736 -175.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.439 ' CE2' ' HD2' ' B' ' 520' ' ' LYS . 49.6 t80 -66.4 -41.76 88.86 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.2 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.23 -45.06 93.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.41 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.463 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 36.7 t90 -56.65 -48.6 77.21 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.145 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.649 ' CZ ' HD11 ' B' ' 501' ' ' LEU . 8.8 t80 -58.43 -47.29 84.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.856 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.439 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 50.6 mtpt -61.11 -42.49 98.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.758 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -65.56 -43.84 88.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.257 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.35 -45.51 83.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.89 0.376 . . . . 0.0 110.548 -178.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 89.4 mt -71.15 -26.91 63.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.608 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.78 36.6 8.42 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.668 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.0 t80 . . . . . 0 C--N 1.327 -0.381 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 39.3 m . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -70.19 162.34 42.66 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.392 2.061 . . . . 0.0 111.045 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -114.67 146.58 40.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.028 0.442 . . . . 0.0 111.422 -175.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.65 124.48 62.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.71 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -88.6 135.37 33.53 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.214 175.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.505 HD11 HG11 ' A' ' 182' ' ' VAL . 94.5 mt -114.71 0.63 13.93 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.46 ' HA ' HG23 ' A' ' 179' ' ' VAL . 31.1 t80 -75.78 -25.41 56.41 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -66.67 -24.71 66.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.742 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.521 HD21 HD21 ' B' ' 504' ' ' LEU . 26.0 mt -62.48 147.95 47.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.852 0.358 . . . . 0.0 110.668 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -62.52 145.33 54.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.56 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.613 HG22 HD12 ' A' ' 178' ' ' LEU . 5.6 p -57.32 -35.58 49.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.588 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -73.26 -33.82 65.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.898 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 34.6 m -65.02 -40.0 94.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.161 0.505 . . . . 0.0 110.07 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.507 ' O ' ' HG2' ' A' ' 162' ' ' LYS . 29.2 mt -65.71 -38.95 90.63 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.487 0.66 . . . . 0.0 110.02 175.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -62.68 -39.39 93.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.225 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 6.6 ttm180 -68.03 -44.32 76.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.929 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.623 ' HA ' HG13 ' B' ' 495' ' ' VAL . 65.8 t80 -51.77 -57.9 7.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.871 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 158' ' ' LEU . 2.6 ptpp? -68.95 -32.4 71.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.2 -36.65 66.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.967 0.413 . . . . 0.0 110.682 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -76.74 -31.37 57.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.702 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -92.97 -4.46 52.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.767 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 60.71 60.31 1.94 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.154 0.502 . . . . 0.0 111.18 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.53 136.22 26.98 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.061 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.83 125.4 16.5 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.485 2.123 . . . . 0.0 111.861 -178.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.477 ' HB ' HD11 ' A' ' 173' ' ' LEU . 19.5 p . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.261 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' A' ' 169' ' ' THR . 87.2 mt . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 121.275 0.559 . . . . 0.0 111.764 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.59 ' HB3' ' HG3' ' A' ' 177' ' ' GLN . 26.2 t-20 -137.82 157.93 45.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.412 -178.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.439 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.6 tptm -46.57 -52.75 12.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 122.704 0.402 . . . . 0.0 111.07 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.74 -42.23 98.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.59 ' HG3' ' HB3' ' A' ' 174' ' ' ASN . 21.5 mt-30 -63.09 -38.01 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.231 0.539 . . . . 0.0 110.345 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.613 HD12 HG22 ' A' ' 155' ' ' VAL . 89.0 mt -64.13 -41.64 97.14 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.113 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.46 HG23 ' HA ' ' A' ' 151' ' ' TYR . 80.8 t -62.49 -41.25 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 O-C-N 123.782 0.676 . . . . 0.0 111.001 177.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.77 -51.19 70.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.597 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.96 -46.62 96.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.97 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.505 HG11 HD11 ' A' ' 150' ' ' LEU . 65.4 t -62.45 -49.16 84.98 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.434 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.85 97.3 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.372 -0.442 . . . . 0.0 112.534 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.78 -44.2 97.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.699 0.285 . . . . 0.0 110.75 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -82.13 -29.81 31.46 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.104 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -58.89 -41.16 86.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.103 0.477 . . . . 0.0 110.498 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -77.52 9.45 3.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.503 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -131.4 14.88 5.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.528 0.204 . . . . 0.0 111.483 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.617 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 66.5 mt -80.73 119.29 75.75 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 120.69 0.281 . . . . 0.0 110.997 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.61 124.52 9.37 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.859 2.373 . . . . 0.0 111.118 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.567 HG22 ' HB3' ' B' ' 485' ' ' LEU . 11.2 p -142.44 128.46 17.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.458 0.647 . . . . 0.0 112.068 -173.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -98.66 127.55 44.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.128 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.5 -60.45 3.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 122.751 0.42 . . . . 0.0 112.13 -175.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -55.17 -57.3 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.89 -174.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -60.59 -44.21 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.622 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 94.9 m -66.13 -41.43 90.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.795 -176.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.19 -45.7 92.22 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 175.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.3 m -61.56 -41.15 96.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.256 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.3 m -62.52 -52.06 64.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.817 178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 204' ' ' VAL . 71.2 t80 -57.98 -57.78 11.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.002 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.596 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 78.6 mt -54.46 -55.16 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -56.8 -40.27 75.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.092 -175.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.9 m -67.44 -48.86 66.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.482 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 200' ' ' PHE . 11.7 t -69.87 -22.55 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 120.936 0.398 . . . . 0.0 110.619 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 10.5 mmm180 . . . . . 0 C--O 1.233 0.217 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.208 173.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.69 0.281 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -59.34 -54.8 42.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.437 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 60.9 m -58.17 -31.53 67.35 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.408 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.5 tt -64.05 -49.69 71.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.683 176.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.486 ' O ' HG21 ' B' ' 471' ' ' VAL . 70.3 t80 -57.05 -56.39 22.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.332 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -62.87 -33.24 74.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -173.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.6 -44.19 82.79 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.068 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.92 -43.44 98.85 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.759 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.486 HG21 ' O ' ' B' ' 467' ' ' PHE . 86.0 t -58.6 -47.67 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 121.038 0.447 . . . . 0.0 110.817 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -39.51 81.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.423 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -76.92 -41.59 42.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.232 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.543 ' HB2' ' CZ ' ' B' ' 512' ' ' PHE . . . -70.31 -46.02 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.976 -174.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.23 -29.62 67.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.71 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 70.72 -60.43 0.5 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.006 0.816 . . . . 0.0 111.833 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 17.1 t -67.04 127.94 34.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.996 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.03 -23.05 64.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.709 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -75.08 -40.66 59.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.698 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.26 84.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.228 176.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.499 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 65.4 t80 -65.81 -32.02 73.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.866 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.551 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 34.9 tt0 -64.47 -44.58 90.61 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 175.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.81 -44.81 78.21 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.412 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 81.9 t80 -55.43 -44.29 76.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.294 0.569 . . . . 0.0 109.978 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.567 ' HB3' HG22 ' A' ' 191' ' ' VAL . 89.3 mt -69.27 -31.19 69.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.354 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.617 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.1 OUTLIER -60.89 -44.06 97.61 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.041 0.448 . . . . 0.0 109.995 173.083 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.0 m -61.23 -36.79 80.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.199 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.53 HD21 ' CG ' ' A' ' 200' ' ' PHE . 45.6 mt -67.48 -47.6 69.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.463 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 14.3 m -65.19 -41.24 91.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.845 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.485 HG12 ' O ' ' B' ' 486' ' ' ARG . 16.1 pt -70.27 -32.94 52.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.944 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -63.68 -44.08 94.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -66.12 -34.01 77.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.533 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -87.79 21.98 2.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.856 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 63.3 25.24 14.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.025 0.441 . . . . 0.0 111.86 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.623 HG13 ' HA ' ' A' ' 161' ' ' TYR . 75.5 t -88.71 -48.47 14.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.34 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 44.1 pt -116.69 160.02 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.463 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.444 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 33.2 m -96.79 -174.0 2.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.18 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.48 ' O ' HG22 ' B' ' 502' ' ' VAL . 20.5 mtp-105 -64.37 -53.35 50.07 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -176.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.21 -48.8 77.89 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -171.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.566 ' HA ' ' HG2' ' B' ' 503' ' ' GLN . 2.5 pm0 -66.29 -32.8 74.42 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.828 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.524 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -58.81 -44.72 90.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.824 0.345 . . . . 0.0 110.487 176.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.48 HG22 ' O ' ' B' ' 498' ' ' ARG . 0.3 OUTLIER -69.82 -41.49 79.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.671 -178.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.566 ' HG2' ' HA ' ' B' ' 500' ' ' GLU . 18.8 pt20 -73.71 -23.33 59.77 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -173.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 85.4 mt -66.8 -38.31 86.24 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.954 -0.466 . . . . 0.0 110.905 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.616 HG21 ' HG ' ' B' ' 509' ' ' LEU . 8.9 p -89.55 6.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.304 0.573 . . . . 0.0 110.599 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.489 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.5 t -61.14 -46.32 95.99 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.851 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.564 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 48.8 Cg_exo -58.63 -16.37 30.06 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.172 1.915 . . . . 0.0 112.765 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -99.95 -52.76 3.34 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.888 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.71 HD22 HD21 ' B' ' 515' ' ' LEU . 76.8 mt -92.09 0.86 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.634 -175.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.6 -17.17 68.61 Favored Glycine 0 C--O 1.23 -0.156 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.513 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.565 ' HD2' ' N ' ' B' ' 511' ' ' LYS . 3.2 mptp? -90.94 -3.54 57.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.388 0.614 . . . . 0.0 109.46 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.543 ' CZ ' ' HB2' ' B' ' 474' ' ' ALA . 43.4 m-85 -129.0 84.79 61.99 Favored Pre-proline 0 N--CA 1.448 -0.567 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.968 -174.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.95 -49.78 16.4 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.42 2.747 . . . . 0.0 112.893 -173.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.98 -34.03 75.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.385 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.71 HD21 HD22 ' B' ' 509' ' ' LEU . 9.8 tp -78.12 -43.78 27.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.377 -173.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.605 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 52.4 t80 -68.13 -37.31 80.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.091 178.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.42 -34.04 75.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.21 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -59.41 -48.47 81.5 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 175.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.489 ' O ' HD13 ' B' ' 523' ' ' LEU . 3.2 t80 -58.04 -44.03 87.15 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.185 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.605 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 88.7 mttt -60.16 -44.07 95.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.073 175.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -63.87 -39.51 94.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.508 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -70.55 -31.58 68.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.44 0.638 . . . . 0.0 110.045 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.524 HD21 HD23 ' B' ' 501' ' ' LEU . 10.6 mp -88.1 1.19 54.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.924 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 59.25 37.31 91.65 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.025 -178.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 19.2 t80 . . . . . 0 C--N 1.322 -0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 110.944 -175.112 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.7 m . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.809 0.338 . . . . 0.0 110.473 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.478 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 15.2 Cg_exo -68.59 142.98 55.14 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.823 2.349 . . . . 0.0 111.612 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -100.73 141.32 33.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.6 p -84.44 129.39 37.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 110.561 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.523 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 10.9 t70 -81.31 100.63 9.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.06 3.29 53.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.2 0.524 . . . . 0.0 110.668 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -76.6 -27.63 55.84 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.626 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.0 OUTLIER -51.82 -41.5 61.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.824 171.51 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.567 HD23 HD11 ' B' ' 504' ' ' LEU . 64.5 mt -61.01 128.19 35.23 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.837 -178.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -62.36 160.86 12.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.521 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.7 -44.18 69.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.122 0.486 . . . . 0.0 110.362 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.59 -37.97 88.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.057 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.422 HG21 HD22 ' A' ' 153' ' ' LEU . 10.6 m -64.35 -45.2 88.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.987 0.422 . . . . 0.0 110.556 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.589 HD12 ' HZ1' ' A' ' 175' ' ' LYS . 71.8 mt -59.86 -46.84 88.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.584 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -63.84 -34.94 79.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.84 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' B' ' 494' ' ' GLU . 13.7 ttm180 -66.1 -46.47 77.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.561 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.584 ' HH ' HD11 ' A' ' 189' ' ' ILE . 83.7 t80 -52.52 -48.02 66.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.365 173.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.614 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 6.5 mtpm? -65.46 -34.78 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.427 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -75.27 -40.54 58.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.762 0.315 . . . . 0.0 111.032 -176.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -74.48 -43.71 54.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.804 0.335 . . . . 0.0 111.327 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.431 ' CE1' HG21 ' B' ' 490' ' ' ILE . 39.2 m-85 -85.48 0.24 52.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.353 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 57.39 73.12 0.48 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.433 176.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.614 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 76.0 mt -113.69 135.23 21.95 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.856 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.16 157.4 25.63 Favored 'Trans proline' 0 C--O 1.238 0.476 0 C-N-CA 123.243 2.629 . . . . 0.0 112.381 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.52 ' HB ' HD11 ' A' ' 173' ' ' LEU . 13.8 p . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.43 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.52 HD11 ' HB ' ' A' ' 169' ' ' THR . 83.3 mt . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 121.297 0.57 . . . . 0.0 111.748 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.704 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 14.0 m120 -138.54 179.75 6.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.033 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.589 ' HZ1' HD12 ' A' ' 158' ' ' LEU . 27.7 tptp -57.4 -53.45 58.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.881 0.372 . . . . 0.0 110.798 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.89 -27.84 67.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.295 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.704 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 31.5 mm-40 -67.77 -44.76 76.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.42 0.629 . . . . 0.0 110.154 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 91.2 mt -64.13 -42.71 96.72 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.837 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.66 -42.41 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.544 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 177' ' ' GLN . 8.0 pt-20 -67.94 -40.85 83.23 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.259 -177.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.4 ' N ' ' HG3' ' A' ' 180' ' ' GLU . 60.0 mt -67.46 -48.71 76.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 120.916 0.389 . . . . 0.0 110.257 176.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.21 -49.05 83.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.706 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.39 96.28 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.546 -177.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 46.7 t -59.05 -46.41 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.969 0.414 . . . . 0.0 110.619 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.77 -26.28 31.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.231 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.559 ' HE1' HD13 ' B' ' 490' ' ' ILE . 35.6 t80 -66.33 -34.85 78.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.176 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -78.33 10.23 3.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.611 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.9 p -136.09 38.82 2.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.948 0.404 . . . . 0.0 111.332 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.875 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 73.8 mt -102.39 115.75 63.98 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.436 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.86 113.22 2.92 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 122.669 2.246 . . . . 0.0 111.918 177.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.581 HG23 ' HB3' ' B' ' 485' ' ' LEU . 9.1 p -115.75 154.21 17.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.761 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -118.62 112.89 20.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 32.6 tt0 -51.3 -65.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -58.4 -48.9 79.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.571 0.224 . . . . 0.0 111.356 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.46 -45.76 78.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.837 -174.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.3 m -68.7 -37.37 79.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.848 -0.16 . . . . 0.0 110.903 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 53.3 mt -60.73 -47.34 86.75 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 40.7 m -57.91 -47.2 83.52 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.644 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.4 -48.24 82.4 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.57 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.528 ' CG ' HD21 ' B' ' 488' ' ' LEU . 68.8 t80 -64.63 -47.95 76.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.285 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.457 HD12 ' HE2' ' B' ' 468' ' ' PHE . 78.8 mt -57.44 -44.62 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.021 -177.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -71.07 -35.0 71.73 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.185 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 73.8 m -60.89 -50.23 74.27 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.733 0.301 . . . . 0.0 110.866 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 200' ' ' PHE . 20.4 t -71.48 -33.51 49.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.064 -177.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.456 178.256 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 463' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.9 p . . . . . 0 N--CA 1.452 -0.366 0 CA-C-O 120.695 0.283 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 50.9 mp0 -62.93 -51.21 67.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.909 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 17.0 t -63.93 -33.32 75.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.95 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 42.7 tp -58.17 -53.9 53.07 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.169 175.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.441 ' O ' HG21 ' B' ' 471' ' ' VAL . 75.3 t80 -54.03 -55.07 30.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.925 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.457 ' HE2' HD12 ' A' ' 201' ' ' ILE . 31.6 m-85 -61.36 -39.5 90.85 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -174.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.8 -39.93 95.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.82 0.343 . . . . 0.0 110.337 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.3 mttt -63.01 -46.25 88.53 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.184 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 467' ' ' PHE . 85.5 t -57.09 -44.47 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.139 0.495 . . . . 0.0 110.521 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -58.43 -42.33 87.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.967 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -80.28 -44.86 18.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.035 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.506 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -61.88 -42.45 99.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' B' ' 477' ' ' SER . 10.6 mp -71.57 -37.95 71.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.217 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 ttp85 70.48 -36.78 0.37 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.976 0.91 . . . . 0.0 111.935 177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 477' ' ' SER . . . . . 0.46 ' H ' ' C ' ' B' ' 475' ' ' LEU . 30.1 t -80.51 121.6 25.98 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.901 0.382 . . . . 0.0 110.875 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.95 72.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.706 177.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -63.34 -42.0 98.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.147 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.478 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -72.06 -40.98 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.243 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.541 ' O ' HD11 ' B' ' 485' ' ' LEU . 72.9 t80 -62.51 -45.01 94.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.395 0.617 . . . . 0.0 109.481 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.509 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 38.9 tt0 -57.29 -43.94 83.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.038 176.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -56.71 -43.92 81.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.801 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -54.77 -51.44 65.73 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.581 ' HB3' HG23 ' A' ' 191' ' ' VAL . 1.5 mp -66.01 -26.25 67.45 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.875 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.0 mtt85 -68.0 -37.35 81.36 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.801 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 47.6 m -63.08 -32.01 73.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.222 0.534 . . . . 0.0 109.741 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.528 HD21 ' CG ' ' A' ' 200' ' ' PHE . 72.0 mt -68.18 -45.71 72.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.356 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.425 HG21 ' HA ' ' B' ' 486' ' ' ARG . 19.4 m -66.01 -40.89 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.555 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.559 HD13 ' HE1' ' A' ' 186' ' ' PHE . 17.3 pt -69.66 -30.82 46.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -66.32 -42.15 88.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 110.006 174.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.6 -35.58 81.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.561 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -89.62 26.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.019 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . 0.532 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 12.4 pt-20 46.14 32.41 1.43 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.29 1.036 . . . . 0.0 112.649 177.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.467 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 63.8 t -81.76 -42.55 19.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.4 pt -116.13 175.87 2.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 16.3 m -115.15 174.95 5.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.065 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.446 ' O ' HG22 ' B' ' 502' ' ' VAL . 60.8 ttp180 -57.51 -52.39 65.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.506 0.193 . . . . 0.0 110.675 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.5 -46.61 83.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.834 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.8 mm-40 -56.02 -50.44 70.91 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.464 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.507 HD21 HD23 ' B' ' 523' ' ' LEU . 64.3 tp -59.79 -49.0 79.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.405 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.53 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 93.1 t -59.89 -38.52 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.626 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 16.2 mm100 -72.25 -38.91 68.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.413 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.567 HD11 HD23 ' A' ' 153' ' ' LEU . 65.6 mt -58.64 -37.55 76.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.448 HG21 ' HG ' ' B' ' 509' ' ' LEU . 5.1 p -91.22 6.01 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.056 0.455 . . . . 0.0 111.4 -175.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.61 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 93.4 p -63.07 -42.17 75.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.61 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 25.8 Cg_exo -65.96 -10.49 27.15 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.88 1.72 . . . . 0.0 112.367 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -99.16 -57.2 2.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.464 HD22 HD22 ' B' ' 515' ' ' LEU . 57.3 mt -92.49 3.04 56.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.811 -175.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.59 -22.58 71.67 Favored Glycine 0 N--CA 1.454 -0.12 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.966 -177.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -87.37 -2.42 58.6 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.506 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 46.3 m-85 -127.04 90.81 48.44 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.923 -176.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.45 -47.21 20.2 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.35 2.7 . . . . 0.0 113.282 -172.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.51 -32.72 66.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.898 0.38 . . . . 0.0 110.918 -176.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.464 HD22 HD22 ' B' ' 509' ' ' LEU . 15.8 tp -71.31 -43.74 66.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.072 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.51 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 28.5 t80 -66.61 -34.97 79.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.995 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -63.87 -39.85 95.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.648 175.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -58.1 -49.06 78.25 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.53 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 37.3 t80 -56.67 -45.86 81.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.763 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.51 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.0 mttt -58.87 -39.98 83.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.721 0.296 . . . . 0.0 111.471 178.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -71.22 -38.72 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.304 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -64.61 -45.34 87.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.849 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.507 HD23 HD21 ' B' ' 501' ' ' LEU . 5.6 mp -83.28 -2.72 56.34 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 64.51 52.32 44.28 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.772 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 . . . . . 0 C--N 1.329 -0.319 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.807 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 90.3 m . . . . . 0 C--O 1.233 0.2 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -71.35 158.72 53.65 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.252 1.968 . . . . 0.0 110.791 173.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -108.82 145.27 35.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.029 0.443 . . . . 0.0 111.339 -175.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.74 135.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.774 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -105.62 131.99 52.31 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 96.2 mt -110.28 5.9 22.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.145 0.497 . . . . 0.0 110.471 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -84.99 -24.19 28.36 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 -28.3 69.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.437 172.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.482 HD22 HD23 ' B' ' 504' ' ' LEU . 59.2 mt -63.75 158.16 22.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.104 0.478 . . . . 0.0 110.989 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . 0.407 HE21 ' CD ' ' B' ' 500' ' ' GLU . 46.6 mt-30 -78.78 148.95 32.76 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.454 177.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.508 HG12 ' CD1' ' A' ' 178' ' ' LEU . 85.6 t -53.96 -45.29 63.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 CA-C-O 121.198 0.523 . . . . 0.0 110.317 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -60.3 -36.6 78.26 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.631 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 26.7 m -68.23 -43.75 77.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.098 0.475 . . . . 0.0 110.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.408 HD21 HG21 ' A' ' 182' ' ' VAL . 88.0 mt -65.03 -38.54 91.22 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.352 0.596 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 79.9 mtp180 -70.72 -30.59 67.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.309 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.489 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 42.2 ttm105 -70.46 -42.76 71.05 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.62 ' HA ' HG11 ' B' ' 495' ' ' VAL . 52.2 t80 -48.86 -58.2 5.2 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.071 173.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 6.4 ptpp? -67.97 -27.37 66.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.71 -176.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -67.81 -51.62 46.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -67.31 -37.2 82.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.011 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -88.85 0.15 56.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt 59.69 74.94 0.42 Allowed 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.669 0.606 . . . . 0.0 111.984 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.588 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 82.5 mt -117.6 110.63 40.38 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.96 176.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.08 127.38 16.7 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.672 2.248 . . . . 0.0 112.129 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.532 ' HB ' HD12 ' A' ' 173' ' ' LEU . 30.7 p . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 120.987 0.422 . . . . 0.0 111.9 -175.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.532 HD12 ' HB ' ' A' ' 169' ' ' THR . 97.9 mt . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.93 0.395 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 16.2 t-20 -120.37 167.24 12.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.472 ' HD3' HG23 ' A' ' 155' ' ' VAL . 21.7 tptm -54.38 -52.49 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.555 0.342 . . . . 0.0 111.29 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.48 -36.81 76.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.349 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.8 ' HA ' HE21 ' A' ' 177' ' ' GLN . 0.0 OUTLIER -64.42 -44.01 92.54 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.15 0.5 . . . . 0.0 110.167 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.559 HD21 ' HZ2' ' A' ' 162' ' ' LYS . 85.7 mt -62.38 -41.17 98.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.778 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 71.2 t -62.28 -43.98 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 123.622 0.576 . . . . 0.0 111.114 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 48.4 mt-10 -61.05 -44.74 96.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.789 0.328 . . . . 0.0 110.771 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.514 HD12 HG22 ' A' ' 169' ' ' THR . 72.5 mt -63.58 -50.62 77.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.581 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.408 HG21 HD21 ' A' ' 158' ' ' LEU . 69.1 t -61.03 -46.18 97.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.557 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.21 -40.61 99.28 Favored Glycine 0 N--CA 1.448 -0.546 0 O-C-N 123.368 0.417 . . . . 0.0 112.618 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -60.02 -43.31 95.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.358 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -78.87 -28.83 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.597 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.1 -29.98 70.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.537 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -80.75 0.41 34.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.11 176.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.8 t -126.1 24.81 6.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.892 0.377 . . . . 0.0 110.74 -175.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.83 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.4 mt -90.17 117.47 68.07 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.885 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.67 118.79 5.6 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.542 2.161 . . . . 0.0 111.157 174.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.8 p -133.42 154.93 39.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.486 -175.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -132.11 128.25 37.73 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.505 ' HG3' ' HE2' ' B' ' 481' ' ' TYR . 34.7 tt0 -51.98 -63.83 1.01 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.94 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -57.08 -53.74 54.69 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.038 0.447 . . . . 0.0 112.059 -174.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -65.61 -46.6 78.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.911 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.5 m -67.03 -36.7 82.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.375 -176.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.526 HD22 ' HH ' ' B' ' 481' ' ' TYR . 45.0 mt -60.64 -45.86 92.51 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 61.1 m -56.97 -45.54 82.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.741 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 62.5 m -60.08 -54.52 45.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.085 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.538 ' CD1' HD22 ' B' ' 488' ' ' LEU . 71.9 t80 -57.27 -48.29 79.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.278 -177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 205' ' ' ARG . 87.8 mt -61.0 -47.23 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.488 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -65.29 -36.45 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.188 -175.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -69.53 -61.22 1.87 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.853 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.22 -29.12 46.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -170.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 201' ' ' ILE . 11.7 mtp180 . . . . . 0 C--N 1.327 -0.386 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 10.0 p . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.632 0.253 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.459 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 0.8 OUTLIER -63.14 -47.46 82.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.096 176.341 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.6 m -60.24 -39.55 87.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.259 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 44.9 tp -59.08 -51.74 68.76 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.461 ' O ' HG21 ' B' ' 471' ' ' VAL . 81.6 t80 -53.89 -56.96 12.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.739 178.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -64.37 -36.58 84.61 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -173.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.45 -41.92 88.38 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.586 -0.446 . . . . 0.0 109.965 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.38 -43.95 97.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.067 178.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.603 HG13 HD23 ' B' ' 509' ' ' LEU . 86.7 t -59.96 -51.91 67.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.16 0.505 . . . . 0.0 110.782 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -58.7 -34.1 70.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.202 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . 0.448 ' HB2' ' HE3' ' B' ' 473' ' ' LYS . 36.9 ttmt -85.19 -31.93 22.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.511 -176.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.89 -39.6 30.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.644 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . 0.496 ' C ' ' H ' ' B' ' 477' ' ' SER . 66.0 mt -62.91 -35.65 80.77 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.934 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 71.81 -28.58 0.19 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.818 0.699 . . . . 0.0 111.836 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 477' ' ' SER . . . . . 0.496 ' H ' ' C ' ' B' ' 475' ' ' LEU . 1.2 p -96.09 120.39 36.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.058 -177.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.72 99.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -60.51 -35.16 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.084 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -71.51 -36.8 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 0.0 110.734 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.526 ' HH ' HD22 ' A' ' 197' ' ' LEU . 44.0 t80 -71.69 -34.57 69.76 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 42.6 tt0 -62.62 -43.03 99.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.709 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.67 -48.58 69.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.705 174.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.436 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 83.9 t80 -55.11 -48.73 73.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.525 176.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 95.3 mt -64.53 -32.21 73.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.644 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.83 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.6 mtt180 -68.89 -38.22 79.51 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.483 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.3 -35.49 75.71 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.013 0.435 . . . . 0.0 109.931 172.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.538 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -65.57 -52.19 54.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.067 179.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.468 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -61.81 -39.63 84.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.432 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.1 pt -69.83 -31.04 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.652 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -67.29 -38.22 84.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 109.97 171.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -72.79 -5.2 36.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.459 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -115.14 13.39 16.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.154 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 59.29 29.33 18.87 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.472 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.62 HG11 ' HA ' ' A' ' 161' ' ' TYR . 71.4 t -80.59 -51.03 16.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.1 0.476 . . . . 0.0 110.333 178.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.5 pt -108.51 167.15 4.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.15 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 27.0 t -101.34 177.75 4.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.949 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 52.5 ttp180 -59.01 -59.46 5.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.179 0.514 . . . . 0.0 110.685 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.35 -40.98 79.21 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.565 -179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.528 ' HA ' ' NE2' ' B' ' 503' ' ' GLN . 8.8 mm-40 -55.45 -42.81 74.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.103 0.477 . . . . 0.0 110.213 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 10.5 tt -64.84 -45.8 84.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.33 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.499 HG13 ' CZ ' ' B' ' 516' ' ' PHE . 0.1 OUTLIER -64.19 -32.51 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.516 -179.239 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.528 ' NE2' ' HA ' ' B' ' 500' ' ' GLU . 16.7 mt-30 -68.12 -43.13 79.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.145 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.482 HD23 HD22 ' A' ' 153' ' ' LEU . 49.3 mt -58.72 -43.51 90.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.106 -177.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.538 HG21 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -91.58 7.91 4.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.15 0.5 . . . . 0.0 111.038 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 20.6 t -59.5 -49.49 92.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.927 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 47.3 Cg_exo -59.68 -17.17 40.94 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.256 1.971 . . . . 0.0 112.898 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -95.9 -57.32 2.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.351 -175.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.648 HD22 HD21 ' B' ' 515' ' ' LEU . 53.2 mt -99.26 -9.4 23.68 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -173.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.16 -23.07 71.27 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.527 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.516 ' HZ2' ' HB3' ' B' ' 511' ' ' LYS . 0.8 OUTLIER -78.78 -5.1 52.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.667 178.276 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -122.12 92.46 48.87 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.783 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -49.64 -48.0 20.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.606 2.871 . . . . 0.0 113.268 -176.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.84 -34.41 77.87 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.088 0.471 . . . . 0.0 111.095 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.648 HD21 HD22 ' B' ' 509' ' ' LEU . 12.9 tp -78.44 -43.8 26.31 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.016 -174.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.511 ' O ' ' HG2' ' B' ' 520' ' ' LYS . 11.8 t80 -69.75 -32.27 70.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.853 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . 0.411 ' O ' ' HB2' ' B' ' 520' ' ' LYS . 25.5 t-20 -66.33 -37.68 85.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.309 175.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.459 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 27.2 t90 -58.02 -46.98 84.41 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -38.5 87.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.93 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' B' ' 516' ' ' PHE . 34.0 mmtp -53.27 -50.52 64.67 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.335 0.588 . . . . 0.0 110.168 174.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.54 -36.27 78.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.86 -175.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -72.78 -39.32 66.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.543 -174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.555 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 10.6 mp -81.53 -19.58 41.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.934 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 74.08 28.22 64.83 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.829 -0.908 . . . . 0.0 110.829 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 36.9 t80 . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 121.171 0.51 . . . . 0.0 110.284 -175.628 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.2 m . . . . . 0 C--O 1.233 0.193 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.421 ' HD2' ' HB1' ' B' ' 480' ' ' ALA . 11.4 Cg_exo -69.68 155.18 66.88 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.711 2.274 . . . . 0.0 111.686 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -107.59 163.91 12.67 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.718 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.8 p -119.85 121.37 65.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.205 0.526 . . . . 0.0 110.819 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -74.2 118.61 17.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.073 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 62.5 mt -106.72 -6.9 17.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.96 0.41 . . . . 0.0 110.841 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.475 ' HA ' HG22 ' A' ' 179' ' ' VAL . 1.9 t80 -75.21 -14.29 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.393 0.615 . . . . 0.0 109.345 176.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.27 -24.64 59.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.9 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.547 HD21 HD22 ' B' ' 504' ' ' LEU . 29.7 mt -68.58 160.25 30.38 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.26 0.552 . . . . 0.0 111.42 -173.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.12 156.24 30.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.094 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.424 HG11 ' CD1' ' A' ' 178' ' ' LEU . 50.2 t -58.92 -44.27 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -56.97 -44.54 82.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.671 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.719 HG22 ' HG2' ' B' ' 500' ' ' GLU . 35.8 m -62.93 -48.38 79.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.112 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.579 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 95.5 mt -63.28 -44.61 94.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 50.5 mtp180 -65.18 -35.88 82.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.615 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -68.14 -43.82 77.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.612 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.535 ' HH ' HD12 ' A' ' 189' ' ' ILE . 62.1 t80 -53.26 -50.0 65.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.074 0.464 . . . . 0.0 110.302 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.547 ' NZ ' HD11 ' A' ' 181' ' ' ILE . 59.7 mtpt -67.83 -29.02 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.615 -177.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.418 ' O ' ' HD3' ' A' ' 166' ' ' LYS . 44.6 ttm180 -79.72 -43.64 22.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.629 0.252 . . . . 0.0 111.024 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -69.15 -42.66 75.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.737 0.304 . . . . 0.0 110.631 -177.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -84.28 -1.31 55.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.53 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . 0.418 ' HD3' ' O ' ' A' ' 163' ' ' ARG . 71.7 mmtt 58.35 66.74 1.04 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.464 178.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.509 HD11 HG21 ' A' ' 181' ' ' ILE . 94.6 mt -101.18 137.31 19.66 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.499 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.34 139.63 78.23 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.825 2.35 . . . . 0.0 111.953 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 37.6 p . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.803 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 121.362 0.601 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.573 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 17.8 m120 -137.14 176.35 8.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.015 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -55.84 -48.73 74.97 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.386 0.429 . . . . 0.0 110.698 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.11 93.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.248 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.573 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 27.9 mm-40 -60.76 -40.42 92.43 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.454 0.645 . . . . 0.0 110.644 -178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.579 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 81.7 mt -63.61 -51.88 63.33 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.745 177.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.475 HG22 ' HA ' ' A' ' 151' ' ' TYR . 96.7 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 123.622 0.576 . . . . 0.0 111.695 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.52 -49.18 77.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.465 -178.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.547 HD11 ' NZ ' ' A' ' 162' ' ' LYS . 65.8 mt -70.6 -42.88 78.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 -179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 178' ' ' LEU . 56.0 t -59.26 -49.38 83.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.389 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.426 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.68 -37.54 94.51 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.424 -0.417 . . . . 0.0 112.661 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.9 t -57.9 -43.05 85.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.912 0.387 . . . . 0.0 110.586 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -86.65 -27.59 23.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.832 0.348 . . . . 0.0 111.17 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.504 ' HE1' HD11 ' B' ' 490' ' ' ILE . 50.3 t80 -61.77 -42.73 99.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 -176.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . 0.411 ' HB3' ' HE3' ' A' ' 187' ' ' LYS . 30.3 mtpp -78.19 17.94 0.57 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 34.9 p -140.59 19.72 2.36 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.457 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.971 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 81.6 mt -78.7 124.03 85.25 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.96 140.55 42.18 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.252 1.968 . . . . 0.0 110.907 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.95 155.78 6.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.919 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -125.32 115.17 19.92 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.637 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.3 tt0 -47.78 -64.76 0.7 Allowed 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -172.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -64.7 -45.84 84.91 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -173.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.24 -41.54 89.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.769 0.319 . . . . 0.0 110.92 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.5 m -66.13 -40.16 90.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.917 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 50.0 mt -58.82 -46.68 87.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 55.8 m -56.04 -48.81 75.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.741 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 60.3 m -57.21 -55.23 37.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.236 177.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.627 ' CD1' HD23 ' B' ' 488' ' ' LEU . 41.6 t80 -52.03 -52.94 47.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.562 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.504 HD12 ' HE2' ' B' ' 468' ' ' PHE . 84.4 mt -56.71 -55.35 20.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.248 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.21 -29.74 63.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -173.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -63.81 -55.27 24.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.343 176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.493 HG11 HD22 ' B' ' 523' ' ' LEU . 58.2 t -65.18 -32.21 57.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.637 -175.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.43 ' HD3' HG21 ' A' ' 201' ' ' ILE . 23.8 mtp180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 112.168 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.0 p . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 120.901 0.382 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.468 ' HA ' ' CH2' ' B' ' 518' ' ' TRP . 3.4 mp0 -58.78 -43.53 90.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.752 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 15.9 m -63.57 -33.01 74.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.003 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 54.8 tp -65.59 -43.25 90.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.21 0.528 . . . . 0.0 109.862 177.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.443 ' O ' HG22 ' B' ' 471' ' ' VAL . 64.6 t80 -54.96 -49.19 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.994 173.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.504 ' HE2' HD12 ' A' ' 201' ' ' ILE . 31.1 m-85 -66.18 -32.07 73.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.77 -177.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.91 -46.31 91.17 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -60.91 -49.08 78.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.834 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.443 HG22 ' O ' ' B' ' 467' ' ' PHE . 92.5 t -59.49 -51.71 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.841 0.353 . . . . 0.0 111.345 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -58.97 -41.68 88.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.519 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' B' ' 473' ' ' LYS . 21.9 ttmt -75.77 -34.35 60.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.317 -175.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.82 -41.27 26.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.716 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.56 -41.96 87.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 121.101 -0.239 . . . . 0.0 110.831 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 40.2 ttt180 70.6 -56.12 0.61 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.847 0.717 . . . . 0.0 111.688 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 28.4 t -65.89 129.62 40.4 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.082 -179.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.02 -40.95 87.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.946 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.88 -31.11 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 0.0 110.054 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.421 ' HB1' ' HD2' ' A' ' 146' ' ' PRO . . . -71.64 -43.51 65.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 177.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.491 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 76.8 t80 -65.54 -39.67 91.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 176.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.5 tt0 -60.09 -43.56 95.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.847 174.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.11 -44.7 75.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.821 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 51.2 t80 -57.53 -48.52 79.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.312 175.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.91 -33.1 74.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.971 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 20.0 mtt85 -66.12 -38.17 87.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.928 0.394 . . . . 0.0 110.452 177.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 53.7 m -62.03 -34.34 76.05 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 173.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -68.11 -46.85 69.78 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.412 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' B' ' 486' ' ' ARG . 15.6 m -64.85 -42.57 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.634 -178.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.504 HD11 ' HE1' ' A' ' 186' ' ' PHE . 22.9 pt -69.51 -29.59 42.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.848 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.33 -42.47 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.105 0.479 . . . . 0.0 109.889 172.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -67.26 -32.57 73.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.965 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.53 7.8 16.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 65.62 21.8 11.68 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.371 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 95.2 t -75.5 -43.07 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.973 0.416 . . . . 0.0 110.096 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.502 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 36.2 pt -120.17 154.96 23.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.717 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 28.3 p -98.99 -171.3 2.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.292 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.566 ' O ' HG23 ' B' ' 502' ' ' VAL . 45.2 ttp180 -55.77 -42.12 75.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.419 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -60.23 -53.4 58.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.571 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.719 ' HG2' HG22 ' A' ' 157' ' ' THR . 2.3 mp0 -60.63 -41.72 95.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.78 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.51 -41.99 86.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.763 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 498' ' ' ARG . 67.3 t -69.4 -40.71 80.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.894 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -74.68 -41.65 59.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.176 -175.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.547 HD22 HD21 ' A' ' 153' ' ' LEU . 91.0 mt -61.26 -36.92 81.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 111.636 -175.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.746 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -92.16 6.81 5.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.969 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.528 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 34.9 t -59.77 -48.33 95.37 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.737 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 24.0 Cg_exo -66.3 -1.56 5.69 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.946 1.764 . . . . 0.0 112.731 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.65 -61.68 1.61 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.764 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.746 ' HG ' HG22 ' B' ' 505' ' ' VAL . 48.1 mt -89.35 -21.16 23.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.151 -175.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -70.44 -10.18 66.02 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.452 -177.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -79.9 -11.83 59.78 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' B' ' 515' ' ' LEU . 60.5 m-85 -124.95 104.33 30.0 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.054 -178.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.13 -50.45 13.36 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.523 2.815 . . . . 0.0 113.586 -175.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -66.51 -41.47 88.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.095 0.474 . . . . 0.0 110.665 -177.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.422 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 22.2 tp -67.0 -45.71 76.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.727 -175.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -67.28 -32.34 73.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.351 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.15 -47.49 79.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.463 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' B' ' 464' ' ' GLU . 4.9 t90 -57.16 -48.56 78.4 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.753 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.507 ' CZ ' HD13 ' B' ' 523' ' ' LEU . 39.5 t80 -56.82 -50.69 71.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.495 -178.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.2 -38.29 90.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.2 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -44.42 91.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.586 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -63.03 -41.38 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.633 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.507 HD13 ' CZ ' ' B' ' 519' ' ' PHE . 88.7 mt -71.08 -26.64 63.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.489 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.55 33.87 15.32 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -173.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.444 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.532 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 53.7 Cg_exo -54.09 147.94 41.77 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.699 2.266 . . . . 0.0 112.131 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -126.64 149.72 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.122 0.487 . . . . 0.0 111.111 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.617 HG22 HD22 ' B' ' 483' ' ' ASN . 0.8 OUTLIER -95.47 138.73 20.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.915 -175.544 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.46 -46.87 68.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.831 0.824 . . . . 0.0 109.787 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.548 HD22 HD23 ' B' ' 504' ' ' LEU . 40.2 mt 60.28 10.04 2.2 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.527 -1.67 . . . . 0.0 111.553 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -94.03 -10.96 31.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -70.39 -29.95 66.72 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.609 HD21 HD13 ' B' ' 504' ' ' LEU . 19.2 mt -59.31 131.62 51.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.219 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -72.29 163.61 27.67 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.914 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.54 -44.17 80.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.758 0.313 . . . . 0.0 110.744 -178.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 24.8 p30 -61.77 -35.43 78.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 48.1 m -71.78 -46.84 57.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.693 0.282 . . . . 0.0 110.97 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 88.1 mt -60.84 -46.82 89.05 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.226 0.536 . . . . 0.0 110.46 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 162' ' ' LYS . 29.5 mtp180 -65.12 -31.83 73.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.677 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.3 ttm180 -67.24 -46.81 72.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.266 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.555 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 57.8 t80 -52.94 -49.76 65.36 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.025 0.44 . . . . 0.0 110.335 174.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.527 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 7.9 mtpm? -57.7 -45.35 85.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.881 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -81.91 -31.7 31.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.514 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . 0.515 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 45.4 t-80 -72.57 -37.99 68.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.556 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -88.41 -8.07 55.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.239 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm 61.33 69.99 0.63 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.766 0.666 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 84.9 mt -105.93 145.15 30.34 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.233 -178.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 21.5 Cg_exo -65.68 150.73 86.03 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.182 2.588 . . . . 0.0 111.928 176.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.471 HG22 ' HZ2' ' A' ' 162' ' ' LYS . 18.7 p . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.092 0.473 . . . . 0.0 112.115 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 85.6 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 121.136 0.493 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.661 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 26.9 m-80 -141.66 177.34 8.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.589 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -56.78 -52.11 66.32 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.182 0.301 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.9 -30.03 69.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.736 0.303 . . . . 0.0 110.847 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.661 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 25.4 mm-40 -64.58 -42.54 95.56 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.146 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 75.3 mt -62.72 -46.97 85.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.056 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.79 -46.03 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.281 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -60.1 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.45 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.2 -49.54 80.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.6 t -59.13 -49.47 83.24 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.91 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.31 92.12 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 121.49 -0.386 . . . . 0.0 112.835 -176.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.48 -48.97 79.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -80.77 -26.14 37.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.034 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.555 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 28.9 t80 -57.28 -48.59 78.52 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 -179.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.9 45.95 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 0.0 111.417 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 61.7 m -152.02 11.38 0.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.196 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.779 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 79.1 mt -89.34 120.93 69.75 Favored Pre-proline 0 C--O 1.234 0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.619 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.08 148.07 49.86 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.836 2.357 . . . . 0.0 111.732 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.26 129.8 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 0.0 111.327 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -91.44 119.63 31.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 169.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.536 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 42.4 tt0 -51.63 -54.17 30.72 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.388 0.43 . . . . 0.0 111.474 -173.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -59.24 -51.47 69.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.85 -43.94 97.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.328 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 196' ' ' THR . . . . . 0.426 HG22 ' HB3' ' B' ' 485' ' ' LEU . 19.9 m -66.34 -42.69 87.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.299 -176.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 80.3 mt -62.98 -41.82 99.66 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 28.3 m -57.46 -46.23 83.87 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.375 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 95.0 m -56.87 -56.19 24.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.478 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.51 ' CG ' HD21 ' B' ' 488' ' ' LEU . 56.1 t80 -62.72 -55.5 26.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.603 -175.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 67.4 mt -56.43 -55.67 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.231 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.89 -34.82 78.62 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -173.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -64.99 -51.63 60.65 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.724 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.513 HG11 HD11 ' B' ' 523' ' ' LEU . 44.4 t -68.92 -28.72 40.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 120.986 0.422 . . . . 0.0 111.05 174.551 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.452 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.465 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -63.58 -38.66 91.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.833 0.349 . . . . 0.0 110.627 177.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 9.9 m -59.26 -43.71 92.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.244 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.73 -48.42 81.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.896 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.479 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.2 t80 -53.48 -52.9 58.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.06 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.465 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.0 m-85 -70.18 -28.93 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -174.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.21 -40.79 82.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -57.95 -50.27 73.95 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.368 172.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 467' ' ' PHE . 84.1 t -54.51 -42.23 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.869 0.366 . . . . 0.0 110.976 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -54.93 -51.57 65.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.313 177.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -78.46 -33.23 48.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.834 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.722 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -70.37 -45.84 65.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.75 -30.67 68.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.679 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 68.94 -51.95 0.58 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.683 0.793 . . . . 0.0 112.427 173.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.4 t -78.77 137.8 37.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.882 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.98 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.594 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.12 -38.77 91.72 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.532 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -66.16 -47.3 74.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.975 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.443 ' CE2' HD12 ' B' ' 485' ' ' LEU . 91.3 t80 -65.62 -42.92 91.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.543 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.1 tt0 -59.43 -40.81 87.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.676 177.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.617 HD22 HG22 ' A' ' 148' ' ' VAL . 3.0 t30 -57.93 -47.61 82.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.686 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -51.73 -49.91 61.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.95 174.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.443 HD12 ' CE2' ' B' ' 481' ' ' TYR . 71.7 mt -63.05 -34.37 77.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.22 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.779 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.2 mtt85 -66.52 -36.54 82.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 51.4 m -61.44 -36.42 80.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.23 0.538 . . . . 0.0 109.657 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.51 HD21 ' CG ' ' A' ' 200' ' ' PHE . 61.9 mt -66.11 -47.74 73.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.569 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.572 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.5 m -65.77 -42.16 91.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -176.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.465 HG12 ' O ' ' B' ' 486' ' ' ARG . 22.7 pt -68.48 -31.39 51.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.601 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.18 -42.02 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.291 0.567 . . . . 0.0 110.02 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -65.95 -31.36 72.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.759 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 77.1 mt-30 -90.39 15.03 11.36 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.552 -177.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 68.75 10.93 8.17 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.128 0.571 . . . . 0.0 112.226 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.46 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 90.0 t -68.85 -55.51 15.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.089 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.431 HG12 HG13 ' B' ' 490' ' ' ILE . 42.3 pt -111.83 152.45 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.428 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 58.2 m -102.5 -177.28 3.35 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.784 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.572 ' O ' HG22 ' B' ' 502' ' ' VAL . 40.2 ttp180 -57.25 -45.94 83.5 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.643 -175.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.89 -51.03 71.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.776 0.322 . . . . 0.0 111.036 -178.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.556 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.7 mp0 -60.21 -44.33 95.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 179.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.47 -46.85 80.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.067 0.461 . . . . 0.0 110.955 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.572 HG22 ' O ' ' B' ' 498' ' ' ARG . 88.5 t -63.1 -35.91 73.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.883 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -77.56 -30.02 52.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.609 HD13 HD21 ' A' ' 153' ' ' LEU . 86.2 mt -71.21 -39.72 71.58 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.29 7.1 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.255 0.55 . . . . 0.0 110.864 -177.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.637 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 31.7 t -57.95 -52.75 72.16 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.721 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.637 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.0 Cg_exo -66.67 -3.39 9.16 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.286 1.991 . . . . 0.0 112.931 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.567 ' CZ ' HG21 ' A' ' 148' ' ' VAL . 95.8 m-85 -109.27 -53.78 2.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.425 -175.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.528 HD21 HD22 ' B' ' 515' ' ' LEU . 87.1 mt -107.1 -6.42 17.41 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -176.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.03 -15.61 69.71 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.006 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.423 ' HG3' ' CE2' ' B' ' 512' ' ' PHE . 0.0 OUTLIER -84.75 1.97 44.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.523 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.722 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 87.9 m-85 -128.54 93.33 38.29 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.853 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.0 Cg_endo -52.55 -54.08 5.78 Favored 'Trans proline' 0 CA--C 1.528 0.198 0 C-N-CA 123.537 2.825 . . . . 0.0 113.345 -173.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -66.94 -33.26 75.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 0.0 111.207 -176.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.528 HD22 HD21 ' B' ' 509' ' ' LEU . 16.3 tp -74.84 -39.16 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 110.26 -178.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -70.15 -30.31 67.43 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 176.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.31 -45.19 95.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.851 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.465 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 19.0 t90 -56.23 -48.41 76.54 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.744 176.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -47.04 76.99 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.537 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.2 -39.82 91.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -66.46 -37.36 84.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.047 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -71.86 -35.12 69.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.112 0.482 . . . . 0.0 110.395 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.513 HD11 HG11 ' A' ' 204' ' ' VAL . 5.2 mp -86.92 -7.15 58.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.492 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.72 40.27 97.84 Favored Glycine 0 N--CA 1.452 -0.248 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 -175.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 45.5 t80 . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.1 0.476 . . . . 0.0 110.675 -173.408 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 86.8 m . . . . . 0 CA--C 1.529 0.172 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 4.5 Cg_exo -74.29 165.22 32.34 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.628 2.218 . . . . 0.0 111.394 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -120.66 152.62 37.96 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.958 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.17 124.83 53.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.136 0.493 . . . . 0.0 110.957 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -81.65 107.06 14.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.772 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.415 HD21 HD23 ' B' ' 504' ' ' LEU . 81.5 mt -91.96 5.27 50.71 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.831 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -80.47 -17.44 51.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -64.68 -27.42 68.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.619 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.535 HD23 HD13 ' B' ' 504' ' ' LEU . 52.1 mt -69.98 142.69 52.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.036 -176.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -70.5 158.14 36.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.073 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.5 t -58.29 -43.1 85.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 110.145 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.99 -40.05 91.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.344 178.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 16.6 m -65.89 -42.8 89.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.107 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 91.8 mt -65.06 -42.01 94.62 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.978 0.418 . . . . 0.0 110.814 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.42 -35.93 82.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.977 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.7 ttm180 -63.66 -39.94 95.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.085 -179.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.482 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 54.3 t80 -60.51 -52.27 65.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.544 173.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.826 ' HZ2' HG23 ' A' ' 181' ' ' ILE . 19.9 mtpp -66.35 -28.69 68.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.069 -175.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -80.04 -39.52 29.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.092 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -70.64 -40.67 72.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.597 0.237 . . . . 0.0 111.232 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -88.6 -0.4 57.22 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.493 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 55.99 82.37 0.11 Allowed 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.677 0.61 . . . . 0.0 111.922 176.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.606 HD12 ' HG2' ' A' ' 162' ' ' LYS . 93.2 mt -114.53 134.1 22.4 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.478 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.61 127.81 7.43 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.527 2.152 . . . . 0.0 112.254 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.512 HG21 ' HZ1' ' A' ' 162' ' ' LYS . 10.6 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.258 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 64.2 mt . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.946 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 16.7 m120 -80.21 168.21 19.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.773 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.653 ' O ' HG21 ' A' ' 179' ' ' VAL . 17.8 tptm -55.88 -54.52 43.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.519 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.02 73.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.946 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 5.8 mm100 -69.22 -40.85 77.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.013 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 94.5 mt -59.83 -44.66 93.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.883 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.653 HG21 ' O ' ' A' ' 175' ' ' LYS . 37.6 t -57.67 -43.05 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.067 -178.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.03 -48.43 78.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.1 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.826 HG23 ' HZ2' ' A' ' 162' ' ' LYS . 67.8 mt -61.93 -46.27 96.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 CA-C-O 120.947 0.403 . . . . 0.0 110.687 179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 66.7 t -59.39 -48.6 86.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.368 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.409 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -58.82 -46.76 93.05 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.376 -0.44 . . . . 0.0 112.714 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.98 -45.64 78.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.928 0.394 . . . . 0.0 111.231 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -79.48 -29.96 41.88 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.923 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.482 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 28.0 t80 -63.47 -43.47 97.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.787 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -68.07 -15.58 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 111.198 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 m -99.33 10.18 41.91 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.566 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.607 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.2 mt -83.26 118.98 73.23 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-O 120.651 0.262 . . . . 0.0 111.185 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.09 114.2 3.54 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.104 2.536 . . . . 0.0 110.925 173.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.03 138.28 52.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.128 0.49 . . . . 0.0 111.241 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -100.28 142.15 32.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.855 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.681 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.7 tt0 -63.59 -64.32 0.93 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -50.08 68.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.19 -171.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -55.62 -39.75 71.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.468 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 37.1 m -75.3 -36.81 61.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.072 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 21.8 mt -60.29 -48.13 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 176.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 63.6 m -59.19 -42.67 91.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 68.5 m -56.54 -55.79 29.41 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.187 0.518 . . . . 0.0 111.696 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.72 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 46.6 t80 -63.44 -48.03 79.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.109 -176.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 82.6 mt -57.61 -52.82 52.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -58.59 -37.67 76.31 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 33.1 m -60.66 -52.26 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.884 0.373 . . . . 0.0 110.74 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 18.9 t -76.54 -24.5 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.915 -174.117 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.413 . . . . 0.0 110.978 177.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 2.8 p . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -61.17 -40.33 93.51 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.098 0.408 . . . . 0.0 111.063 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 68.4 m -63.12 -34.05 76.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.906 0.384 . . . . 0.0 110.486 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.64 -47.45 69.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.583 ' O ' HG23 ' B' ' 471' ' ' VAL . 74.9 t80 -52.59 -59.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.427 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.72 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 58.6 m-85 -63.55 -39.37 94.24 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -174.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.79 -41.41 95.84 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.991 0.424 . . . . 0.0 110.186 177.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.2 -42.32 93.66 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.326 178.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.583 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.9 t -60.67 -51.35 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-O 120.955 0.407 . . . . 0.0 110.204 175.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -55.04 -34.85 63.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.454 -177.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -87.06 -51.03 6.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.818 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -71.39 -25.54 62.4 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -172.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' B' ' 475' ' ' LEU . 12.1 tp -70.44 -19.76 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? 73.59 -43.39 0.55 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 124.071 0.857 . . . . 0.0 111.497 173.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 26.1 t -97.99 125.15 42.79 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.939 0.399 . . . . 0.0 111.273 -177.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -70.76 -27.8 64.2 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.806 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.16 -44.24 89.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.604 176.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.528 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -65.25 -40.0 93.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.599 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.842 176.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.41 ' HG2' ' HE ' ' B' ' 486' ' ' ARG . 27.5 tt0 -58.57 -44.21 89.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.251 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.45 -40.95 98.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.699 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.65 -47.56 81.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.31 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 83.3 mt -66.07 -30.55 71.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.028 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.607 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.9 mtm105 -68.92 -38.31 79.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.804 0.335 . . . . 0.0 110.793 176.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 55.8 m -60.74 -34.09 73.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.195 0.521 . . . . 0.0 109.857 171.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.524 HD23 ' CD1' ' A' ' 200' ' ' PHE . 31.8 mt -69.11 -45.62 69.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.917 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.438 HG21 ' HA ' ' B' ' 486' ' ' ARG . 24.3 m -62.9 -44.6 99.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.102 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.481 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 43.6 pt -67.1 -30.46 49.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.941 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -62.27 -45.09 94.84 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.185 0.517 . . . . 0.0 110.31 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -73.33 -29.23 62.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.079 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -81.6 12.77 3.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.448 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 64.52 27.58 13.41 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.032 0.444 . . . . 0.0 111.148 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.569 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.6 t -87.66 -46.85 15.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.653 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.411 HG12 HG13 ' B' ' 490' ' ' ILE . 48.0 pt -120.02 160.96 19.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.231 178.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.8 t -100.77 178.44 4.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.104 177.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.578 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 35.1 ttp180 -54.44 -52.39 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -50.97 -52.91 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.66 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.432 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.2 mp0 -58.29 -47.41 83.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.999 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.6 tp -55.29 -45.64 76.21 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.071 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.558 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 58.2 t -63.52 -38.54 82.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.965 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -74.99 -38.22 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.685 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.535 HD13 HD23 ' A' ' 153' ' ' LEU . 90.1 mt -62.33 -37.16 84.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.785 0.326 . . . . 0.0 111.813 -176.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.45 HG21 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -88.78 2.77 6.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.03 0.443 . . . . 0.0 111.183 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.529 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 28.2 t -59.07 -49.23 94.27 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.084 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 51.5 Cg_exo -55.91 -23.93 45.28 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 121.785 1.657 . . . . 0.0 112.571 176.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -87.88 -64.57 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.029 -177.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.629 HD23 HD23 ' B' ' 515' ' ' LEU . 64.7 mt -89.47 3.07 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.785 -172.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.43 -27.46 70.84 Favored Glycine 0 N--CA 1.453 -0.174 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.488 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -87.02 1.35 53.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.754 0.311 . . . . 0.0 110.801 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -125.3 85.5 58.27 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.971 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.19 -54.88 3.99 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.154 2.569 . . . . 0.0 113.56 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -62.88 -31.88 73.02 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 111.376 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.629 HD23 HD23 ' B' ' 509' ' ' LEU . 20.9 tp -76.67 -42.04 43.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.281 0.562 . . . . 0.0 110.218 -177.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.422 ' HD1' ' HB2' ' B' ' 509' ' ' LEU . 32.1 t80 -70.97 -34.37 71.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.092 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -71.58 -30.51 65.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.724 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -61.44 -48.1 82.68 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.558 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 34.6 t80 -54.96 -43.24 73.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.357 177.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.405 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.3 mttt -62.52 -46.46 88.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.109 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -60.36 -42.17 95.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.756 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -66.7 -41.21 88.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 -176.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.578 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 9.5 mp -82.75 -4.6 58.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.667 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 63.88 37.18 94.28 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.261 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 60.1 t80 . . . . . 0 N--CA 1.448 -0.54 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.084 -175.764 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 C--O 1.233 0.216 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.425 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 45.0 Cg_endo -73.49 155.39 50.4 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 121.893 1.729 . . . . 0.0 110.845 174.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -129.58 157.4 42.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.903 0.382 . . . . 0.0 111.246 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.1 p -97.42 125.11 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.726 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.462 ' C ' ' H ' ' A' ' 151' ' ' TYR . 18.4 p-10 -94.43 96.62 9.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.344 0.593 . . . . 0.0 109.756 176.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.556 HD23 HD12 ' B' ' 504' ' ' LEU . 92.6 mt -71.48 25.27 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.462 ' H ' ' C ' ' A' ' 149' ' ' ASP . 3.3 t80 -96.57 -4.81 40.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 120.958 0.409 . . . . 0.0 109.994 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.65 -24.14 29.17 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.538 HD23 HD13 ' B' ' 504' ' ' LEU . 79.4 mt -62.63 135.52 57.42 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.231 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -74.98 163.26 27.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.405 177.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.91 -35.73 41.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.49 -44.89 95.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.767 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.44 HG22 ' HA ' ' B' ' 496' ' ' ILE . 8.4 m -69.65 -42.41 74.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.085 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.66 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.8 mt -61.25 -43.46 98.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.394 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -66.17 -34.86 78.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.74 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.663 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 34.7 ttm180 -68.16 -45.75 72.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.14 -178.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.523 ' HH ' HD13 ' A' ' 189' ' ' ILE . 48.4 t80 -52.89 -51.6 60.57 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.592 ' HZ2' ' HB3' ' A' ' 162' ' ' LYS . 10.2 mtpm? -59.95 -38.83 83.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.024 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -76.66 -44.97 31.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.242 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -70.04 -30.9 68.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.601 0.238 . . . . 0.0 111.002 -176.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.521 ' CZ ' HG23 ' B' ' 490' ' ' ILE . 62.6 m-85 -96.15 0.3 51.08 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.185 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.61 75.22 0.34 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.741 0.651 . . . . 0.0 111.846 178.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 89.2 mt -110.18 106.82 58.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.906 177.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -65.26 125.7 15.01 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.347 2.031 . . . . 0.0 111.784 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.575 HG21 HD13 ' A' ' 181' ' ' ILE . 20.3 p . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.98 -175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.9 mt . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.138 0.494 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.694 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 16.3 t-20 -145.3 169.08 18.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 153' ' ' LEU . 22.3 tptm -50.66 -49.64 56.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.751 0.31 . . . . 0.0 110.4 176.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . 0.521 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -63.24 -40.43 97.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.119 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.694 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 62.3 mm-40 -62.57 -46.92 86.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.551 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.66 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 83.1 mt -61.21 -43.22 99.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.537 -178.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.427 HG21 ' CD1' ' A' ' 151' ' ' TYR . 57.1 t -60.37 -43.34 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.221 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.9 mt-10 -64.18 -41.75 96.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.906 0.384 . . . . 0.0 110.954 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.575 HD13 HG21 ' A' ' 169' ' ' THR . 81.3 mt -68.65 -50.88 51.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.822 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.486 HG11 HD12 ' A' ' 150' ' ' LEU . 77.9 t -58.44 -45.69 89.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.082 177.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 187' ' ' LYS . . . -62.2 -42.05 99.72 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.733 -178.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.72 -45.55 93.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.83 0.348 . . . . 0.0 110.555 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -77.24 -29.92 54.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.704 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -63.07 -30.64 71.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.635 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 183' ' ' GLY . 72.8 mmtt -67.67 -12.51 60.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.659 178.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 17.0 m -133.87 59.62 1.73 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.067 0.46 . . . . 0.0 111.252 -176.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.778 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 67.8 mt -105.79 119.14 53.43 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.782 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.94 126.86 14.39 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.869 2.379 . . . . 0.0 111.17 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.518 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -142.15 131.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.103 0.478 . . . . 0.0 111.537 -175.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -109.36 125.44 52.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.938 177.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.6 tt0 -49.32 -62.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -172.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -55.89 -60.25 3.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -175.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.54 -42.01 64.02 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.115 0.483 . . . . 0.0 111.376 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 56.9 m -68.72 -41.05 79.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.188 -176.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 60.5 mt -66.11 -48.7 70.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.341 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.1 m -56.34 -46.49 79.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.755 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . 0.566 ' HA ' ' CE2' ' A' ' 202' ' ' TYR . 71.2 m -62.2 -48.85 78.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.246 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.575 ' CD1' HD21 ' B' ' 488' ' ' LEU . 82.6 t80 -60.38 -49.29 78.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.861 0.362 . . . . 0.0 110.633 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.461 HD12 ' HE2' ' B' ' 468' ' ' PHE . 61.9 mt -58.0 -52.17 61.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.769 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . 0.566 ' CE2' ' HA ' ' A' ' 199' ' ' CYS . 2.2 p90 -69.45 -35.3 75.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.915 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 44.8 m -64.93 -50.99 64.29 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.755 0.312 . . . . 0.0 110.629 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.422 HG23 ' CE1' ' A' ' 200' ' ' PHE . 47.0 t -69.58 -25.58 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.929 -176.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.444 ' HD3' HG22 ' A' ' 201' ' ' ILE . 33.6 mtp180 . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 120.775 0.321 . . . . 0.0 111.338 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.692 0.282 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -64.95 -48.08 75.36 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 3.6 m -63.19 -35.92 81.9 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.863 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 59.5 tp -60.41 -49.13 78.79 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.413 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.541 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.0 t80 -53.43 -57.68 9.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.42 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.461 ' HE2' HD12 ' A' ' 201' ' ' ILE . 54.5 m-85 -62.52 -33.6 75.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.508 -175.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.83 -44.76 84.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.231 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -67.73 -32.45 73.07 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.22 176.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 467' ' ' PHE . 76.2 t -59.85 -50.65 79.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.002 0.429 . . . . 0.0 109.935 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . 0.425 ' HG3' ' CE1' ' B' ' 481' ' ' TYR . 4.7 mtt-85 -56.28 -49.61 73.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.591 175.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -65.44 -41.38 93.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.049 -175.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -81.64 -40.7 22.52 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -68.39 -39.08 81.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.99 -178.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 71.03 -47.56 0.66 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.72 0.637 . . . . 0.0 111.884 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 27.3 t -72.92 130.54 40.62 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.98 0.419 . . . . 0.0 110.535 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.0 69.79 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.814 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -75.04 -34.28 61.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.53 -42.49 74.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 177.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.486 ' HH ' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.73 -40.49 96.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.066 175.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.715 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 30.2 tt0 -65.09 -38.16 89.84 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.87 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 13.9 t-20 -55.35 -47.6 75.51 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.967 174.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.518 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 85.8 t80 -53.6 -44.39 69.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.937 176.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.518 ' HB3' HG21 ' A' ' 191' ' ' VAL . 83.1 mt -69.98 -28.96 65.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.383 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.778 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 21.6 mmt85 -63.2 -49.28 74.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.512 0.673 . . . . 0.0 109.335 174.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.6 m -57.8 -35.76 71.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.216 176.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.575 HD21 ' CD1' ' A' ' 200' ' ' PHE . 24.8 mt -65.79 -54.45 26.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.309 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.6 m -58.64 -42.53 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.92 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.521 HG23 ' CZ ' ' A' ' 165' ' ' PHE . 20.8 pt -70.6 -31.32 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.881 -0.728 . . . . 0.0 111.161 179.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.22 -37.54 75.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.588 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.81 -30.44 71.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.265 0.555 . . . . 0.0 110.075 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.56 1.02 50.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.327 175.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 56.52 36.94 28.37 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.185 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.663 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.8 t -78.6 -46.24 24.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.408 174.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.44 ' HA ' HG22 ' A' ' 157' ' ' THR . 39.8 pt -102.9 141.67 18.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.721 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.533 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 8.0 m -81.76 179.21 7.92 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.558 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.571 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.4 ttm180 -60.21 -57.87 10.97 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.823 -0.172 . . . . 0.0 110.629 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.96 70.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.018 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.533 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 19.8 mm-40 -61.14 -49.97 75.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.521 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.495 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 61.5 tp -59.35 -45.74 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.879 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.571 HG23 ' O ' ' B' ' 498' ' ' ARG . 57.6 t -61.06 -40.7 86.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.186 -178.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -82.84 -22.41 34.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 150' ' ' LEU . 11.5 tp -67.31 -49.88 62.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.525 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.542 HG22 ' HB2' ' B' ' 508' ' ' PHE . 9.8 p -86.18 13.05 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.55 -176.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 22.8 t -57.19 -45.07 99.96 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' B' ' 506' ' ' SER . 11.7 Cg_endo -59.24 -17.95 42.12 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.287 1.991 . . . . 0.0 113.009 174.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.542 ' HB2' HG22 ' B' ' 505' ' ' VAL . 27.4 m-85 -105.71 149.12 26.69 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . . . . . . . . . 71.9 mt 68.56 -17.73 0.18 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . 0.448 ' H ' ' C ' ' B' ' 508' ' ' PHE . . . -65.89 -15.03 61.89 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.501 -0.381 . . . . 0.0 113.295 -176.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.8 mptp? -85.09 -10.39 56.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.109 0.481 . . . . 0.0 109.779 177.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -123.2 92.96 48.61 Favored Pre-proline 0 C--O 1.235 0.334 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.95 -175.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.05 -53.53 6.99 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.316 2.677 . . . . 0.0 113.564 -174.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -57.91 -37.42 74.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 111.948 -176.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 15.6 tp -79.48 -43.35 23.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.575 -171.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.457 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 0.6 OUTLIER -70.88 -28.41 64.53 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.141 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -67.73 -42.99 81.01 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -53.32 -48.58 68.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.495 ' HZ ' ' HG ' ' B' ' 501' ' ' LEU . 43.0 t80 -55.68 -52.41 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.137 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 58.2 mttp -59.76 -40.39 88.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.94 0.4 . . . . 0.0 111.076 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -69.66 -32.78 71.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.534 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . 0.409 ' CZ ' ' HG3' ' A' ' 205' ' ' ARG . 54.5 t80 -82.41 -31.91 29.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.736 0.779 . . . . 0.0 108.972 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.548 HD23 HG21 ' B' ' 502' ' ' VAL . 15.4 tp -81.76 -10.18 59.43 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.904 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.74 39.24 96.43 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.324 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 62.2 t80 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 120.907 0.384 . . . . 0.0 110.552 -178.495 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.525 ' HD2' ' HB1' ' B' ' 480' ' ' ALA . 52.6 Cg_exo -56.55 151.12 47.99 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.761 2.307 . . . . 0.0 112.385 178.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -104.84 142.24 35.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.371 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.97 106.22 19.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.412 0.625 . . . . 0.0 110.316 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -65.56 114.04 4.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.93 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 77.8 mt -100.1 -0.11 39.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.243 0.544 . . . . 0.0 110.369 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -75.3 -20.84 58.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.183 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.424 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 3.0 pt20 -70.29 -25.97 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.457 178.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.431 HD23 HD22 ' B' ' 504' ' ' LEU . 59.2 mt -68.29 161.29 27.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.327 0.584 . . . . 0.0 111.29 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.39 158.11 30.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.251 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.13 -44.77 92.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.159 0.504 . . . . 0.0 109.658 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -62.09 -35.28 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.082 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 41.4 m -67.36 -45.82 75.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.842 0.353 . . . . 0.0 110.824 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.98 -40.17 90.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.198 0.523 . . . . 0.0 110.802 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 163' ' ' ARG . 94.5 mtt180 -67.03 -37.24 83.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.347 175.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.516 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.8 ttm180 -61.46 -45.0 96.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.079 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.552 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 75.6 t80 -53.33 -50.28 65.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.091 173.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.478 ' HZ1' ' HB ' ' A' ' 181' ' ' ILE . 47.5 mttp -58.64 -45.49 89.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.144 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 159' ' ' ARG . 30.8 mmm180 -72.56 -39.29 67.56 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.407 -175.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -71.94 -33.72 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 111.344 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -93.29 3.11 56.18 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.421 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt 61.56 48.95 5.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.764 173.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 85.7 mt -92.55 134.09 28.51 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.134 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 14.6 Cg_exo -69.39 127.32 14.71 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.032 2.488 . . . . 0.0 111.808 176.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.553 ' HB ' HD11 ' A' ' 173' ' ' LEU . 16.6 p . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 121.056 0.455 . . . . 0.0 111.352 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' A' ' 169' ' ' THR . 85.8 mt . . . . . 0 C--O 1.233 0.226 0 CA-C-O 121.418 0.628 . . . . 0.0 111.634 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 11.1 t-20 -136.06 159.93 40.2 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.588 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.64 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.3 tptm -48.16 -54.31 13.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.289 0.368 . . . . 0.0 111.425 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . 0.471 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -61.1 -37.47 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.113 -178.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.409 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.1 mm100 -63.92 -40.96 97.7 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.377 0.608 . . . . 0.0 110.068 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 182' ' ' VAL . 87.9 mt -61.16 -49.77 75.89 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 177.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 175' ' ' LYS . 19.0 t -56.92 -47.06 83.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 O-C-N 123.777 0.673 . . . . 0.0 111.034 -178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.0 mt-10 -58.7 -50.11 75.1 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.478 ' HB ' ' HZ1' ' A' ' 162' ' ' LYS . 67.3 mt -61.96 -39.0 82.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.858 0.361 . . . . 0.0 110.761 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.586 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 71.9 t -64.02 -49.56 81.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.707 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.43 -33.71 85.61 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.473 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.03 -49.12 79.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.824 0.345 . . . . 0.0 110.298 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -83.57 -23.53 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.056 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.586 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.3 t80 -58.54 -40.67 83.61 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.88 0.472 . . . . 0.0 110.67 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.78 0.23 27.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.87 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -107.25 13.77 26.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.809 0.338 . . . . 0.0 111.027 -179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.68 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 74.7 mt -90.89 116.61 66.79 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.899 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.4 112.09 3.45 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.657 2.238 . . . . 0.0 111.345 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.0 p -120.11 137.2 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -108.23 136.38 47.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.178 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -58.25 -61.87 2.25 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -55.98 -55.81 28.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.624 -176.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.09 -49.24 69.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.9 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 38.9 m -69.32 -44.94 70.68 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.415 HD12 ' HH ' ' B' ' 481' ' ' TYR . 56.4 mt -60.12 -41.52 92.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.92 0.39 . . . . 0.0 110.129 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 54.4 m -58.93 -47.55 84.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.86 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.87 -45.97 92.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.563 ' CD1' HD23 ' B' ' 488' ' ' LEU . 65.6 t80 -61.43 -58.86 6.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.312 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.474 HD12 ' HE2' ' B' ' 468' ' ' PHE . 67.8 mt -56.38 -43.41 77.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.025 0.441 . . . . 0.0 110.707 -175.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -62.52 -46.38 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.179 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 21.3 m -68.71 -39.94 80.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.678 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.525 HG22 ' O ' ' A' ' 200' ' ' PHE . 21.6 t -75.69 -25.78 17.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.867 0.365 . . . . 0.0 111.099 -176.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 205' ' ' ARG . 13.3 mtp180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 110.553 173.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.1 t . . . . . 0 CA--C 1.531 0.219 0 CA-C-O 120.863 0.364 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.406 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 7.2 mp0 -66.68 -52.66 42.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 178.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.0 t -63.01 -34.06 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.885 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.491 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 42.2 tp -59.24 -50.85 72.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.829 175.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 68.5 t80 -52.91 -52.45 57.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.72 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.474 ' HE2' HD12 ' A' ' 201' ' ' ILE . 35.2 m-85 -62.87 -36.51 83.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -176.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.27 -39.01 86.0 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . 0.491 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 64.0 mttm -59.85 -49.65 76.86 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.397 174.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.583 HG13 HD21 ' B' ' 509' ' ' LEU . 64.2 t -55.95 -48.0 79.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 121.334 0.587 . . . . 0.0 110.302 177.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -59.59 -33.67 71.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.05 -177.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -86.26 -50.18 7.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.415 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -67.76 -32.4 72.96 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.86 -21.04 66.03 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 64.93 0.43 1.2 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 477' ' ' SER . . . . . 0.402 ' HB3' ' HB1' ' B' ' 480' ' ' ALA . 40.4 t -134.82 129.98 35.35 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.915 0.388 . . . . 0.0 110.86 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.03 -39.23 90.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.364 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.12 -31.51 72.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.96 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.525 ' HB1' ' HD2' ' A' ' 146' ' ' PRO . . . -64.78 -47.19 79.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.424 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 75.8 t80 -65.75 -35.9 82.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.832 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.29 -38.03 89.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.442 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.44 ' HA ' ' HB2' ' B' ' 486' ' ' ARG . 7.1 t30 -72.78 -30.99 64.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.12 0.486 . . . . 0.0 110.323 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 68.4 t80 -60.48 -50.48 73.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.314 0.578 . . . . 0.0 109.471 171.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 75.5 mt -64.83 -29.1 70.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.457 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.68 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 2.4 tpp85 -60.19 -49.11 78.9 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.861 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 37.9 m -63.04 -31.13 72.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.57 175.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.563 HD23 ' CD1' ' A' ' 200' ' ' PHE . 33.6 mt -68.88 -45.19 71.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.585 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.441 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.2 m -65.83 -40.73 88.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.264 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.553 HD13 ' HE1' ' A' ' 186' ' ' PHE . 39.9 pt -67.84 -32.44 56.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 119.689 -0.804 . . . . 0.0 110.487 177.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -63.93 -43.03 97.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.251 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -63.5 -29.64 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.186 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 79.3 mt-30 -95.17 17.84 13.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.799 -177.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 59.95 27.15 16.48 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.407 0.683 . . . . 0.0 112.056 177.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.516 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 88.0 t -78.21 -41.56 26.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.303 0.573 . . . . 0.0 109.606 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.517 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 48.1 pt -124.68 154.17 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.819 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.3 t -102.94 -169.4 1.65 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.51 ' O ' HG22 ' B' ' 502' ' ' VAL . 19.5 ttm180 -55.54 -55.48 31.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.442 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -54.01 -50.45 66.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.486 -176.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.517 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 2.4 mp0 -59.91 -46.31 89.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.118 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.423 HD22 HD21 ' B' ' 523' ' ' LEU . 65.2 tp -57.83 -44.7 86.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.918 0.39 . . . . 0.0 111.114 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.629 HG23 HD22 ' B' ' 523' ' ' LEU . 59.7 t -67.79 -36.39 75.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.424 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 26.5 mt-30 -77.27 -35.11 55.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.266 -177.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 91.1 mt -65.7 -37.71 87.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 0.0 111.503 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.7 p -87.11 6.7 2.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.967 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.6 t -59.01 -49.2 94.62 Favored Pre-proline 0 CA--C 1.542 0.638 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.741 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 36.8 Cg_exo -63.06 -6.38 9.51 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.228 1.952 . . . . 0.0 113.132 177.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.47 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 68.3 m-85 -108.4 -66.02 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.665 -178.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.583 HD21 HG13 ' B' ' 471' ' ' VAL . 82.4 mt -90.99 -13.15 33.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.72 -12.06 66.81 Favored Glycine 0 C--O 1.23 -0.109 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.077 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -80.15 -13.66 59.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.352 0.596 . . . . 0.0 109.8 176.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.76 89.47 47.84 Favored Pre-proline 0 N--CA 1.451 -0.416 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.809 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -51.88 -35.94 61.68 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.319 2.679 . . . . 0.0 113.313 -177.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.18 -48.64 50.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.275 0.559 . . . . 0.0 110.408 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.499 HD22 HD23 ' B' ' 509' ' ' LEU . 18.0 tp -67.07 -38.8 86.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.475 0.655 . . . . 0.0 110.044 -178.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -67.29 -32.33 73.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.031 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -40.46 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.821 176.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.406 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 9.7 t90 -58.65 -49.22 78.31 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.541 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 18.2 t80 -56.95 -46.08 82.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.909 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.66 -37.05 85.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.172 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -65.34 -38.91 91.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.438 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -82.42 -35.02 28.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.562 0.696 . . . . 0.0 109.745 -175.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.629 HD22 HG23 ' B' ' 502' ' ' VAL . 11.8 tp -85.31 -24.9 27.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.367 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 88.87 26.99 25.22 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.638 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 53.8 t80 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 120.844 0.354 . . . . 0.0 110.272 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 C--O 1.234 0.278 0 CA-C-O 120.757 0.313 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.504 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 7.4 Cg_exo -70.81 147.23 55.65 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.305 2.003 . . . . 0.0 111.064 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -107.92 152.44 24.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.892 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 5.5 p -99.6 121.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.148 0.499 . . . . 0.0 110.348 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -77.57 121.09 23.43 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 85.3 mt -109.38 8.27 25.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.153 0.501 . . . . 0.0 110.616 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -90.8 -25.94 19.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.446 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.472 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 25.6 pt20 -63.71 -26.42 68.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.458 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.707 HD21 ' HB3' ' B' ' 500' ' ' GLU . 63.7 mt -66.31 161.8 21.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.404 -177.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -79.15 154.63 29.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.606 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.561 HG11 ' CD1' ' A' ' 178' ' ' LEU . 37.0 t -61.31 -39.25 82.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.808 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -64.66 -30.01 71.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.541 0.21 . . . . 0.0 110.479 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 17.2 m -68.9 -45.96 69.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.127 0.489 . . . . 0.0 110.395 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.4 mt -65.28 -41.3 94.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.713 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 163' ' ' ARG . 82.8 mtp180 -66.35 -33.36 75.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.455 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.478 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 18.3 ttm180 -65.41 -44.71 86.57 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.601 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 68.0 t80 -55.74 -50.16 71.13 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.552 174.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.873 ' HZ3' HG21 ' A' ' 181' ' ' ILE . 21.3 mtpp -64.66 -38.71 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.442 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 81.8 mtp180 -76.9 -34.77 57.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.764 0.316 . . . . 0.0 110.738 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -69.85 -47.68 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -85.06 -1.89 57.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.443 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm 58.49 81.36 0.16 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.722 0.639 . . . . 0.0 111.129 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.541 ' HB2' ' HZ1' ' A' ' 162' ' ' LYS . 82.4 mt -116.19 100.53 53.56 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.626 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.47 141.72 89.86 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.263 2.642 . . . . 0.0 111.978 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.404 ' CG2' HD13 ' A' ' 173' ' ' LEU . 4.1 t . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.712 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.404 HD13 ' CG2' ' A' ' 169' ' ' THR . 83.5 mt . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.233 0.54 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.09 -175.56 3.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.726 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.66 ' O ' HG22 ' A' ' 179' ' ' VAL . 19.6 tptm -58.87 -58.37 8.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.233 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.28 69.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 0.0 111.359 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -59.96 -50.45 73.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.306 0.574 . . . . 0.0 110.739 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.561 ' CD1' HG11 ' A' ' 155' ' ' VAL . 68.1 mt -60.51 -43.65 96.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.66 HG22 ' O ' ' A' ' 175' ' ' LYS . 21.9 t -57.85 -45.76 87.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.972 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.62 -46.6 89.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.08 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.873 HG21 ' HZ3' ' A' ' 162' ' ' LYS . 63.1 mt -65.4 -45.72 92.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.3 t -60.74 -49.54 84.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.787 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.13 -38.56 95.8 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.169 -0.538 . . . . 0.0 112.235 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.21 -51.55 69.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.575 0.226 . . . . 0.0 110.772 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -80.83 -24.5 38.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.744 0.307 . . . . 0.0 111.183 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.601 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 15.5 t80 -61.48 -44.64 96.74 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.452 -178.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -82.37 22.6 0.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 111.416 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -126.99 22.58 6.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.169 0.509 . . . . 0.0 110.143 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.709 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.9 mt -97.72 118.83 63.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.183 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 7.1 Cg_exo -72.93 113.48 3.78 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 122.969 2.446 . . . . 0.0 110.807 174.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.7 p -119.49 156.43 21.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.877 0.37 . . . . 0.0 111.18 -172.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . 0.511 ' O ' ' HB ' ' A' ' 196' ' ' THR . 92.3 m-20 -107.71 147.84 30.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.093 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.639 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.7 tt0 -72.28 -66.4 0.65 Allowed 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.597 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -73.43 -45.25 55.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.495 -172.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.76 -42.74 99.82 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.158 -176.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 196' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 192' ' ' ASN . 99.4 m -72.68 -38.03 67.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.359 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 37.6 mt -57.69 -51.01 71.28 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 19.5 m -58.49 -44.73 89.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.623 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.2 t -55.06 -54.72 39.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.361 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.597 ' CD1' HD21 ' B' ' 488' ' ' LEU . 70.0 t80 -57.79 -48.65 79.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.616 -177.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 197' ' ' LEU . 91.7 mt -54.89 -51.7 50.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.944 -178.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -67.42 -30.73 70.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.741 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.8 m -63.64 -52.03 62.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 0.0 110.931 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.451 HG22 ' O ' ' A' ' 200' ' ' PHE . 13.7 t -68.63 -27.67 37.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.166 0.508 . . . . 0.0 110.264 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.362 176.676 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.238 0.453 0 CA-C-O 121.193 0.52 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -58.81 -36.83 75.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.906 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.3 t -60.01 -39.49 85.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.839 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.405 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 59.9 tp -60.56 -49.07 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.065 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -53.73 -54.92 31.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.777 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.43 ' HE2' HD12 ' A' ' 201' ' ' ILE . 38.6 m-85 -65.32 -33.56 76.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.73 -175.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.53 -42.76 98.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.982 0.42 . . . . 0.0 110.133 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . 0.405 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 65.8 mttm -58.42 -51.29 70.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.27 174.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . 93.8 t -57.07 -44.35 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.95 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -58.03 -37.44 74.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.382 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -86.86 -38.42 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.979 0.419 . . . . 0.0 111.351 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.642 ' HB3' ' CE2' ' B' ' 512' ' ' PHE . . . -65.88 -49.19 68.98 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 -174.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.75 -31.14 72.22 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.216 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 69.32 -59.47 0.48 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.951 0.782 . . . . 0.0 111.986 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -64.42 130.8 45.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.43 78.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.326 176.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -69.63 -39.27 77.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.504 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -66.62 -44.39 82.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.156 177.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.411 ' CE2' HD12 ' B' ' 485' ' ' LEU . 84.5 t80 -64.91 -41.14 95.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.931 0.396 . . . . 0.0 110.045 177.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.588 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.2 tt0 -60.07 -43.42 95.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.547 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.6 -45.26 89.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.811 178.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.481 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 63.3 t80 -54.33 -48.78 70.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.359 174.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.411 HD12 ' CE2' ' B' ' 481' ' ' TYR . 82.9 mt -63.88 -34.7 78.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.943 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.709 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 18.9 mtt85 -66.23 -36.98 84.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.744 0.307 . . . . 0.0 110.339 176.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.37 -34.27 75.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.488 . . . . 0.0 109.752 174.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.597 HD21 ' CD1' ' A' ' 200' ' ' PHE . 39.7 mt -68.23 -45.14 74.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.453 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' B' ' 486' ' ' ARG . 14.9 m -67.14 -42.5 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.694 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.466 HD12 ' CE1' ' A' ' 186' ' ' PHE . 28.0 pt -68.54 -31.18 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.515 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.2 -43.91 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.146 173.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.3 -37.33 85.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.199 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.8 16.0 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.772 -176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 67.35 10.95 8.11 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 122.608 0.363 . . . . 0.0 111.665 177.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.495 HG13 ' HA ' ' A' ' 161' ' ' TYR . 77.2 t -70.91 -42.46 77.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 111.61 -174.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 45.3 pt -117.56 151.25 19.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.732 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.689 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 13.5 m -75.49 160.03 30.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.423 ' O ' ' HB3' ' B' ' 501' ' ' LEU . 16.5 ttp180 -67.48 -36.54 81.32 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.802 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -64.54 -43.95 92.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.349 . . . . 0.0 110.333 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.707 ' HB3' HD21 ' A' ' 153' ' ' LEU . 9.3 mm-40 -55.86 -38.8 70.6 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.656 176.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.423 ' HB3' ' O ' ' B' ' 498' ' ' ARG . 60.2 tp -61.58 -49.78 75.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.471 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.573 HG11 ' CZ ' ' B' ' 516' ' ' PHE . 0.4 OUTLIER -59.21 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.176 0.512 . . . . 0.0 109.791 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . 0.472 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 44.9 mt-30 -66.51 -42.0 87.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.806 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.589 HD23 HD12 ' A' ' 153' ' ' LEU . 50.2 mt -61.02 -41.97 97.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.878 0.37 . . . . 0.0 111.544 -178.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . 0.697 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -87.09 4.06 4.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.016 -178.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.505 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 33.7 t -58.83 -48.39 96.91 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.944 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.505 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 52.7 Cg_exo -56.73 -20.66 36.04 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.808 1.672 . . . . 0.0 112.734 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.416 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 72.8 m-85 -96.66 -60.59 1.57 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.182 -175.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.697 ' HG ' HG22 ' B' ' 505' ' ' VAL . 55.6 mt -84.61 -19.84 32.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.077 -175.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.16 -8.92 52.66 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.316 -0.468 . . . . 0.0 112.344 -179.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -73.31 -21.58 60.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 174.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.642 ' CE2' ' HB3' ' B' ' 474' ' ' ALA . 31.8 m-85 -128.0 101.96 22.31 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.86 -49.55 16.57 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.124 2.549 . . . . 0.0 112.704 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -56.9 -43.9 81.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 0.0 111.336 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.58 -44.58 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.998 -174.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.573 ' CZ ' HG11 ' B' ' 502' ' ' VAL . 7.9 t80 -70.34 -29.94 66.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.429 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -67.27 -42.26 84.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.842 176.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -54.96 -48.52 73.1 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.484 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.492 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 29.5 t80 -56.45 -51.38 68.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.967 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.437 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 99.2 mttt -59.53 -34.98 73.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.855 0.359 . . . . 0.0 110.917 178.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -66.69 -35.33 79.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.013 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -78.91 -34.09 44.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.22 0.533 . . . . 0.0 110.367 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.439 ' CD2' HG22 ' B' ' 502' ' ' VAL . 11.0 mp -80.7 -16.26 54.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.401 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 69.85 37.11 75.0 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.287 -175.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 14.1 t80 . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 121.111 0.481 . . . . 0.0 110.446 -176.361 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 N--CA 1.451 -0.408 0 CA-C-O 121.176 0.512 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 31.6 Cg_exo -58.86 152.63 56.19 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.707 2.271 . . . . 0.0 111.756 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -123.53 135.65 54.13 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 -174.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . 0.492 HG13 HD22 ' B' ' 483' ' ' ASN . 4.1 p -96.23 124.77 49.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.315 -177.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 50.9 m-20 -86.39 110.82 19.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.25 176.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . 0.414 HD11 HG13 ' A' ' 182' ' ' VAL . 65.8 mt -90.68 -3.84 57.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.423 0.63 . . . . 0.0 109.885 177.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -77.1 -11.16 59.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.36 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 29.7 pt20 -90.63 -9.38 47.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.291 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.404 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.8 mt -77.08 166.06 23.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.2 0.524 . . . . 0.0 111.649 -175.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . 0.433 HE21 ' HB2' ' A' ' 154' ' ' GLN . 17.2 mt-30 -71.97 154.84 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.343 176.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.94 -42.56 93.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.615 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.34 -31.55 71.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.364 -179.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.43 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 10.0 m -66.12 -42.39 89.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.264 0.554 . . . . 0.0 110.469 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . 0.518 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 75.7 mt -65.49 -41.62 93.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.249 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.66 -39.21 93.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.248 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -56.88 -52.89 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.477 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.586 ' HH ' HD11 ' A' ' 189' ' ' ILE . 58.1 t80 -52.34 -52.28 54.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.06 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.566 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 58.6 mtpt -65.37 -31.5 72.64 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.598 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.71 -47.85 20.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.605 0.24 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . 0.428 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 16.0 t-80 -70.09 -35.98 74.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.791 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.433 ' CE1' HG23 ' B' ' 490' ' ' ILE . 59.0 m-85 -88.86 6.38 39.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.626 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt 56.76 51.42 10.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.73 175.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 162' ' ' LYS . 90.7 mt -91.76 131.49 35.56 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.575 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 36.0 Cg_exo -59.84 150.16 79.25 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.936 2.424 . . . . 0.0 111.855 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.644 -177.746 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 61.9 mt . . . . . 0 CA--C 1.516 -0.349 0 CA-C-O 121.409 0.623 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.517 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 17.1 t-20 -137.48 166.6 23.47 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.076 -0.965 . . . . 0.0 108.671 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.604 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.8 tptm -50.3 -53.12 30.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.358 0.411 . . . . 0.0 110.699 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.79 -40.61 88.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.445 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . 0.4 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 24.6 mm-40 -60.05 -46.2 90.31 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.487 0.66 . . . . 0.0 110.257 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.518 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 77.2 mt -60.73 -51.13 70.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.171 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 175' ' ' LYS . 46.3 t -57.28 -43.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.275 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 47.6 mt-10 -58.74 -55.57 33.4 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.283 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . 0.566 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 63.8 mt -63.22 -42.24 95.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.607 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.44 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 47.2 t -58.66 -49.73 81.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.231 177.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . 0.447 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -64.57 -37.24 94.15 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.131 -0.556 . . . . 0.0 112.247 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.1 t -56.67 -48.1 78.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.741 0.305 . . . . 0.0 110.651 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -83.58 -24.73 31.4 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.752 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.579 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 54.4 t80 -60.9 -34.28 74.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 64.4 mttm -81.69 -1.03 45.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.896 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.4 t -130.96 45.63 2.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 110.285 -175.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.682 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 64.2 mt -103.16 115.1 64.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.677 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.36 110.1 1.51 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.349 2.033 . . . . 0.0 111.131 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.415 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.6 p -134.18 128.66 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.067 0.461 . . . . 0.0 111.165 -174.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -104.42 126.45 51.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.097 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.647 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 38.5 tt0 -49.69 -65.21 0.6 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -172.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -58.44 -50.04 75.14 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -60.45 -41.6 94.42 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.934 -179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 66.8 m -66.78 -41.6 87.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 27.5 mt -58.31 -49.22 77.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -57.2 -47.24 81.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.04 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 78.2 m -58.46 -54.85 42.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.074 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.481 ' CG ' HD21 ' B' ' 488' ' ' LEU . 92.6 t80 -60.94 -47.09 88.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.225 -176.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.422 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 73.0 mt -57.58 -53.49 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.185 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -70.82 -22.66 62.31 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.287 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 72.3 m -67.57 -50.81 56.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.652 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 37.4 t -73.73 -25.06 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 111.068 -177.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 12.2 mmm180 . . . . . 0 N--CA 1.464 0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.138 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.12 -52.01 67.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.963 0.411 . . . . 0.0 109.958 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.1 m -62.26 -34.54 76.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.444 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.01 -48.81 78.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.349 177.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.543 ' O ' HG22 ' B' ' 471' ' ' VAL . 61.3 t80 -52.5 -55.72 20.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.834 176.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.526 ' CD1' HD23 ' A' ' 197' ' ' LEU . 79.2 m-85 -65.04 -32.78 74.67 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -174.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -63.19 -41.81 99.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.127 0.489 . . . . 0.0 109.897 174.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -68.36 -33.66 74.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.85 176.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.543 HG22 ' O ' ' B' ' 467' ' ' PHE . 97.2 t -61.47 -49.22 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 177.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -62.77 -35.15 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.151 0.5 . . . . 0.0 109.869 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -76.27 -23.85 54.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.467 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -88.42 -54.98 3.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.355 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.61 -44.35 96.53 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 68.46 -56.95 0.5 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.011 0.819 . . . . 0.0 112.588 173.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 477' ' ' SER . . . . . 0.425 ' HB3' ' CB ' ' B' ' 480' ' ' ALA . 21.8 t -59.11 137.96 57.75 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.798 0.439 . . . . 0.0 110.802 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -60.32 -55.92 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.309 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.93 -32.82 72.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.515 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -68.77 -50.97 46.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.473 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.27 -37.43 85.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.992 0.425 . . . . 0.0 110.328 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 26.4 tt0 -67.21 -34.54 77.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.77 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . 0.492 HD22 HG13 ' A' ' 148' ' ' VAL . 20.7 t-20 -59.94 -43.4 94.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.434 175.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.1 -45.33 79.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.08 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.415 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.3 mt -66.51 -29.52 69.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.116 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.704 ' HG2' ' O ' ' B' ' 482' ' ' GLU . 17.6 mmt85 -60.46 -46.25 90.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 174.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.7 m -61.97 -34.94 77.06 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.667 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.481 HD21 ' CG ' ' A' ' 200' ' ' PHE . 38.8 mt -66.61 -49.37 66.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.525 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 9.7 m -64.71 -42.01 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.672 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.476 HD11 ' HE1' ' A' ' 186' ' ' PHE . 12.1 pt -69.91 -31.11 46.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.128 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . 0.49 ' HB2' HD13 ' B' ' 501' ' ' LEU . 91.2 t80 -65.44 -44.0 88.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.167 0.508 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.19 -35.52 79.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.653 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . 0.428 ' HB3' ' CE1' ' A' ' 164' ' ' HIS . 77.7 mt-30 -83.62 14.6 3.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.644 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 62.22 28.91 17.3 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.643 0.259 . . . . 0.0 111.149 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 69.1 t -87.46 -50.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.067 -178.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 46.4 pt -111.26 148.08 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 54.3 p -91.7 -178.66 5.12 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.446 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.689 ' HD3' ' HB2' ' B' ' 525' ' ' TYR . 26.6 ttm180 -55.99 -52.3 64.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.55 -48.35 81.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.352 -177.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.7 mm-40 -57.21 -46.77 82.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.605 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.49 HD13 ' HB2' ' B' ' 491' ' ' PHE . 9.6 tt -61.76 -49.29 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.051 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 498' ' ' ARG . 94.7 t -63.15 -30.68 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.878 0.371 . . . . 0.0 111.008 -176.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.11 -36.65 55.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.696 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 67.4 mt -65.63 -41.19 92.94 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.876 0.37 . . . . 0.0 111.506 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 7.3 p -84.25 8.84 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.17 0.51 . . . . 0.0 111.206 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.655 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.6 t -57.46 -53.05 69.6 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.054 -179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.655 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 17.1 Cg_exo -69.09 0.2 5.48 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 122.409 2.073 . . . . 0.0 112.93 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.448 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 81.6 m-85 -109.56 -69.35 0.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.822 0.344 . . . . 0.0 110.565 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 516' ' ' PHE . 70.0 mt -86.75 -16.85 35.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.626 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.22 -15.29 65.26 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.277 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -84.18 -11.91 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.182 0.515 . . . . 0.0 110.2 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -123.03 93.71 48.0 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.692 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.51 -54.14 5.95 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.641 2.894 . . . . 0.0 113.555 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.74 -34.91 70.02 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' B' ' 515' ' ' LEU . 4.4 tp -80.56 -39.95 26.78 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.001 0.429 . . . . 0.0 110.257 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 2.9 t80 -67.61 -38.65 84.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.852 178.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -65.69 -42.66 90.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.68 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -57.5 -48.05 80.27 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.437 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.2 OUTLIER -58.91 -46.58 87.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.348 -178.872 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.96 -44.74 96.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.393 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -64.31 -40.53 96.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.712 -177.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -69.9 -41.97 73.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.507 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.47 HD21 ' HZ ' ' A' ' 200' ' ' PHE . 78.2 mt -77.93 -6.89 55.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.104 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 72.27 32.17 62.92 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.043 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . 0.689 ' HB2' ' HD3' ' B' ' 498' ' ' ARG . 64.4 t80 . . . . . 0 C--N 1.321 -0.643 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 16.0 m . . . . . 0 CA--C 1.533 0.303 0 CA-C-O 120.472 0.177 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.555 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 24.5 Cg_exo -63.85 152.15 81.99 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.433 2.089 . . . . 0.0 111.112 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -131.38 150.56 52.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.894 0.378 . . . . 0.0 111.399 -175.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.71 144.5 9.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.383 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.78 -47.96 17.72 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 112.104 -173.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt 71.57 -38.64 0.43 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.19 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -65.31 -26.15 67.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.571 0.7 . . . . 0.0 109.195 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -55.93 -24.27 36.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.312 174.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.578 HD13 HD23 ' B' ' 504' ' ' LEU . 75.4 mt -75.47 154.61 36.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.237 0.541 . . . . 0.0 111.275 -176.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.66 142.58 58.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.695 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . 0.565 ' HB ' ' HD3' ' A' ' 175' ' ' LYS . 5.1 p -58.4 -31.67 43.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.875 0.369 . . . . 0.0 110.577 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.32 -38.98 88.95 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.542 175.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.609 HG21 ' HG2' ' B' ' 500' ' ' GLU . 39.0 m -67.92 -40.07 83.44 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 75.0 mt -63.85 -44.47 93.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.332 0.587 . . . . 0.0 110.006 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -62.59 -33.66 75.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.169 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.638 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 28.4 ttm180 -67.11 -43.67 81.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.078 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.5 ' HA ' HG11 ' B' ' 495' ' ' VAL . 69.7 t80 -54.88 -56.31 20.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.838 174.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -67.23 -31.84 72.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.433 -174.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -73.06 -43.42 61.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.705 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -66.91 -41.67 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.546 -178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.98 -4.36 52.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.135 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 56.84 56.65 5.26 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.22 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 88.9 mt -88.57 124.04 66.74 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.339 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.85 127.71 24.36 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.749 2.3 . . . . 0.0 111.548 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.548 ' HB ' HD11 ' A' ' 173' ' ' LEU . 1.3 p . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 121.089 0.471 . . . . 0.0 112.135 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . 0.548 HD11 ' HB ' ' A' ' 169' ' ' THR . 99.1 mt . . . . . 0 C--O 1.232 0.161 0 CA-C-O 121.223 0.535 . . . . 0.0 111.855 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.537 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 19.7 t-20 -108.15 159.36 16.66 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.725 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.565 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.8 tptm -49.17 -49.27 43.34 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 122.765 0.426 . . . . 0.0 111.143 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.8 -39.92 91.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.101 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -60.27 -39.58 87.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.125 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 86.3 mt -59.21 -54.68 44.18 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.051 176.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 175' ' ' LYS . 21.5 t -56.93 -40.82 74.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 123.833 0.708 . . . . 0.0 111.296 -176.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.7 -50.92 71.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.722 0.296 . . . . 0.0 110.874 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -65.59 -42.88 93.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 78.9 t -58.38 -49.29 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.35 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.02 94.11 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.575 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -59.42 -45.65 90.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.932 0.396 . . . . 0.0 110.684 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 -83.69 -22.92 31.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.451 . . . . 0.0 110.618 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.0 t80 -65.47 -41.79 92.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.747 -178.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -71.63 -11.36 60.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.411 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 4.9 p -116.46 22.91 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.912 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 78.2 mt -75.59 125.4 88.63 Favored Pre-proline 0 C--O 1.236 0.359 0 CA-C-O 120.58 0.229 . . . . 0.0 110.456 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 12.6 Cg_exo -70.18 126.41 13.0 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.992 2.461 . . . . 0.0 110.963 174.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 3.8 p -147.21 155.26 11.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.94 -175.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -136.09 133.03 36.88 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.271 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.63 -64.67 0.74 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -55.91 -53.61 54.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.434 -171.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.99 -43.94 97.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.743 0.306 . . . . 0.0 111.822 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 33.3 m -68.61 -43.14 77.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.237 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.13 -49.91 76.08 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 24.9 m -57.85 -46.69 84.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.864 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.38 -49.64 76.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.772 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.535 ' CD1' HD23 ' B' ' 488' ' ' LEU . 61.2 t80 -61.93 -54.77 37.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.215 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 73.6 mt -58.08 -46.05 88.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.198 0.523 . . . . 0.0 110.872 -177.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.58 -40.27 96.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.152 -176.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 16.5 m -70.67 -54.61 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.124 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 43.8 t -61.47 -35.59 67.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 . . . . . 0 C--N 1.331 -0.238 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 178.758 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.53 0.205 0 CA-C-O 120.48 0.181 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -60.4 3.56 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.79 175.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 39.1 m -65.28 -26.67 68.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.88 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.71 -52.74 59.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.049 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.502 ' O ' HG22 ' B' ' 471' ' ' VAL . 63.7 t80 -54.88 -58.81 6.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.614 176.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -65.01 -27.63 68.96 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -172.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -71.36 -42.13 68.86 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.957 0.408 . . . . 0.0 109.992 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -61.51 -45.49 93.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.191 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.511 HG11 HD22 ' B' ' 509' ' ' LEU . 84.8 t -55.95 -47.66 79.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.797 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -59.41 -40.58 87.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.433 -178.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -79.41 -35.02 41.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.728 0.299 . . . . 0.0 111.198 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -70.91 -46.72 62.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 50.7 mt -61.04 -43.55 98.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.494 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 25.6 ttt180 70.68 -61.2 0.48 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.154 0.909 . . . . 0.0 112.326 172.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 477' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' B' ' 480' ' ' ALA . 30.8 t -62.87 145.19 55.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.719 -176.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.44 -50.84 63.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.627 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.61 -24.4 64.57 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.359 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.555 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.88 -56.08 15.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.053 0.454 . . . . 0.0 110.186 177.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' B' ' 485' ' ' LEU . 62.4 t80 -66.74 -37.16 84.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.255 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.613 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 34.2 tt0 -63.99 -45.87 87.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.438 179.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -60.39 -39.84 88.75 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.493 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 67.5 t80 -55.57 -49.91 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.135 174.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' B' ' 481' ' ' TYR . 88.6 mt -65.06 -33.97 77.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.188 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.912 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 26.1 mtt180 -64.85 -41.3 95.81 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.893 0.377 . . . . 0.0 110.277 177.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 61.4 m -60.87 -34.73 75.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.979 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.535 HD23 ' CD1' ' A' ' 200' ' ' PHE . 44.3 mt -66.99 -52.41 42.98 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.086 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' B' ' 486' ' ' ARG . 10.8 m -59.6 -42.24 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -177.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.579 ' HA ' ' HG2' ' B' ' 493' ' ' GLN . 17.1 pt -70.47 -32.31 49.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.146 -0.622 . . . . 0.0 111.132 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -64.97 -45.7 84.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.196 0.522 . . . . 0.0 110.176 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -63.94 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.029 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . 0.802 ' HG3' HG22 ' B' ' 495' ' ' VAL . 10.7 pt20 -93.68 13.3 22.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.303 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 67.6 35.59 4.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.308 173.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.802 HG22 ' HG3' ' B' ' 493' ' ' GLN . 64.8 t -88.8 -52.91 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.029 0.443 . . . . 0.0 110.061 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.436 HG12 HG13 ' B' ' 490' ' ' ILE . 49.5 pt -110.08 145.02 17.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.125 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 497' ' ' SER . . . . . 0.429 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.2 t -84.93 178.49 7.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.981 0.419 . . . . 0.0 110.385 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.58 ' O ' HG22 ' B' ' 502' ' ' VAL . 9.5 ttp180 -55.38 -47.7 75.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.251 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.09 -53.11 62.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.162 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . 0.609 ' HG2' HG21 ' A' ' 157' ' ' THR . 1.9 mp0 -56.6 -40.31 75.09 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.78 HD21 HD23 ' B' ' 523' ' ' LEU . 67.8 tp -60.03 -49.39 77.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 110.939 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.58 HG22 ' O ' ' B' ' 498' ' ' ARG . 8.1 t -68.06 -30.32 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.41 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.47 -46.08 70.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.344 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.578 HD23 HD13 ' A' ' 153' ' ' LEU . 86.4 mt -62.37 -40.31 96.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.988 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -87.23 6.78 2.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.084 0.468 . . . . 0.0 111.194 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.651 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 40.3 t -56.19 -52.98 68.59 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.733 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.651 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.3 Cg_exo -66.58 -7.94 19.5 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.055 1.837 . . . . 0.0 113.056 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . 0.458 ' O ' ' HD3' ' B' ' 511' ' ' LYS . 96.5 m-85 -100.15 -50.18 4.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.516 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . 0.511 HD22 HG11 ' B' ' 471' ' ' VAL . 86.9 mt -106.6 -8.45 16.96 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.392 -177.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.44 -20.17 69.42 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.269 -176.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.458 ' HD3' ' O ' ' B' ' 508' ' ' PHE . 0.0 OUTLIER -83.05 -5.11 58.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.745 0.307 . . . . 0.0 110.652 177.797 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.413 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 58.7 m-85 -118.71 93.23 45.79 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 9.4 Cg_endo -51.8 -54.23 5.66 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.483 2.788 . . . . 0.0 113.673 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -65.1 -44.57 88.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.303 0.573 . . . . 0.0 110.429 -176.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.64 -42.72 98.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.797 -176.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -72.09 -31.98 66.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.691 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -70.26 -34.69 73.12 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.506 177.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -60.25 -49.22 78.47 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.663 ' O ' HD11 ' B' ' 523' ' ' LEU . 33.1 t80 -54.98 -53.53 54.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.506 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -56.17 -40.94 74.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.784 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -63.46 -35.94 82.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.978 0.418 . . . . 0.0 110.459 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -65.07 -41.4 95.13 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.653 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.78 HD23 HD21 ' B' ' 501' ' ' LEU . 3.6 mp -76.98 -15.35 59.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.205 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.62 34.06 63.27 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -171.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 69.2 t80 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.013 -0.593 . . . . 0.0 110.494 -174.226 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' PRO . . . . . 0.459 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 19.3 Cg_exo -63.47 148.1 92.81 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.069 1.846 . . . . 0.0 110.888 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -106.32 158.42 16.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.828 0.347 . . . . 0.0 111.038 -173.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.4 p -110.22 131.79 60.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.412 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -87.92 124.88 34.14 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 88.6 mt -110.17 5.97 22.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -94.01 -15.93 24.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -73.48 -19.5 60.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.397 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' LEU . . . . . 0.497 HD12 HD22 ' B' ' 504' ' ' LEU . 72.5 mt -71.41 156.52 39.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 111.39 -177.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -69.98 158.75 35.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.365 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.51 -41.4 92.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.81 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -64.98 -39.78 93.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.507 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' THR . . . . . 0.421 ' CG2' HG23 ' B' ' 496' ' ' ILE . 25.0 m -57.36 -47.91 80.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.096 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.35 -41.86 96.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.684 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -65.98 -33.52 75.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.623 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' ARG . . . . . 0.467 ' HD3' ' O ' ' B' ' 495' ' ' VAL . 17.9 ttt85 -67.29 -44.4 79.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.212 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' TYR . . . . . 0.565 ' HH ' HD11 ' A' ' 189' ' ' ILE . 65.5 t80 -53.47 -49.98 66.3 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.444 172.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' LYS . . . . . 0.651 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 9.1 mtpm? -56.9 -42.17 79.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.802 -179.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -72.94 -47.65 43.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.602 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -71.79 -31.58 66.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' PHE . . . . . 0.427 ' CE1' HG21 ' B' ' 490' ' ' ILE . 32.3 m-85 -93.29 1.96 56.78 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.064 178.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 58.2 73.95 0.45 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.448 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 92.4 mt -114.73 107.66 50.28 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.415 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.01 126.2 14.82 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.404 2.069 . . . . 0.0 111.419 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' THR . . . . . 0.469 HG23 ' HE2' ' A' ' 162' ' ' LYS . 15.0 p . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.266 -175.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 121.135 0.493 . . . . 0.0 111.386 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 174' ' ' ASN . . . . . 0.619 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 59.4 m-80 -136.18 177.05 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.689 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 175' ' ' LYS . . . . . 0.563 ' O ' HG21 ' A' ' 179' ' ' VAL . 20.9 tptm -53.03 -56.07 18.91 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.405 0.44 . . . . 0.0 111.791 -176.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -59.67 -35.5 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.182 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -66.63 -46.83 74.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.271 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 178' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 69.7 mt -60.04 -48.02 83.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 179' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 175' ' ' LYS . 49.0 t -58.27 -43.33 85.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.943 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -45.94 91.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.581 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 72.5 mt -66.43 -47.64 83.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 CA-C-O 120.994 0.426 . . . . 0.0 110.616 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 182' ' ' VAL . . . . . 0.447 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 74.1 t -59.87 -49.58 83.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.499 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.53 -40.49 98.78 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.412 -0.423 . . . . 0.0 112.255 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 44.2 t -54.91 -48.55 72.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.807 0.337 . . . . 0.0 110.947 178.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -83.64 -24.95 31.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -177.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 186' ' ' PHE . . . . . 0.567 ' HE1' HD11 ' B' ' 490' ' ' ILE . 39.1 t80 -64.72 -39.43 93.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 122.87 0.468 . . . . 0.0 110.963 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -74.75 5.53 4.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.682 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.4 p -133.43 24.02 4.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.659 0.266 . . . . 0.0 111.477 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 189' ' ' ILE . . . . . 0.565 HD11 ' HH ' ' A' ' 161' ' ' TYR . 68.4 mt -86.73 117.69 69.03 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.612 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.66 122.59 9.78 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.808 2.339 . . . . 0.0 111.168 175.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 191' ' ' VAL . . . . . 0.537 HG23 ' HB3' ' B' ' 485' ' ' LEU . 8.4 p -134.5 147.36 29.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.906 0.384 . . . . 0.0 110.97 -175.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -118.04 118.47 32.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.142 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 193' ' ' GLU . . . . . 0.497 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 86.8 tt0 -48.78 -58.78 4.26 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 0.0 112.633 -173.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 194' ' ' LYS . . . . . 0.417 ' C ' ' HD2' ' A' ' 194' ' ' LYS . 0.5 OUTLIER -64.68 -49.18 71.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.497 0.189 . . . . 0.0 111.166 -173.368 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.0 -46.51 84.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.792 0.329 . . . . 0.0 111.369 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.5 m -63.03 -41.28 99.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.43 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 197' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 59.1 mt -60.42 -46.37 90.24 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 175.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 47.2 m -58.61 -46.68 86.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.732 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 66.1 m -57.05 -54.61 44.84 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.545 177.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 200' ' ' PHE . . . . . 0.505 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.7 t80 -56.56 -53.11 61.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.348 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 201' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 197' ' ' LEU . 74.7 mt -55.85 -52.09 52.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.484 -175.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -70.51 -25.94 63.36 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.2 m -72.17 -46.36 56.67 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.706 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 204' ' ' VAL . . . . . 0.471 HG22 ' O ' ' A' ' 200' ' ' PHE . 22.0 t -76.2 -35.33 27.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.204 -175.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 205' ' ' ARG . . . . . 0.559 ' HD2' ' OE2' ' B' ' 464' ' ' GLU . 17.9 mtp180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.068 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 120.715 0.293 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 464' ' ' GLU . . . . . 0.559 ' OE2' ' HD2' ' A' ' 205' ' ' ARG . 1.7 mp0 -54.98 -44.45 74.46 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 175.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.0 t -60.5 -40.35 91.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.023 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 466' ' ' LEU . . . . . 0.494 HD22 ' HE3' ' B' ' 470' ' ' LYS . 8.9 tt -62.14 -49.33 76.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.798 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 467' ' ' PHE . . . . . 0.525 ' O ' HG22 ' B' ' 471' ' ' VAL . 75.5 t80 -54.16 -58.04 8.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.721 176.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 468' ' ' PHE . . . . . 0.401 ' HE1' ' HZ ' ' B' ' 484' ' ' PHE . 46.1 m-85 -64.54 -29.59 70.62 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -174.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.01 -45.04 78.75 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 470' ' ' LYS . . . . . 0.494 ' HE3' HD22 ' B' ' 466' ' ' LEU . 89.8 mttt -64.31 -40.14 95.32 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.701 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 471' ' ' VAL . . . . . 0.525 HG22 ' O ' ' B' ' 467' ' ' PHE . 87.1 t -59.79 -42.19 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.499 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.49 -46.36 83.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.921 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -75.67 -34.35 60.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.375 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 474' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -69.75 -53.8 16.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.967 -175.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.46 -33.98 76.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.207 -176.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 69.2 -59.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.962 0.789 . . . . 0.0 112.04 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.5 t -62.52 126.68 28.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.057 0.456 . . . . 0.0 111.261 -178.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.07 -30.36 70.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.023 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -72.79 -40.71 65.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.924 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 480' ' ' ALA . . . . . 0.459 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.46 -43.41 97.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.468 176.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 481' ' ' TYR . . . . . 0.456 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 47.2 t80 -66.53 -38.53 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.081 178.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 482' ' ' GLU . . . . . 0.498 ' HG3' ' CG1' ' A' ' 191' ' ' VAL . 37.8 tt0 -60.62 -40.48 92.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.204 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.43 -42.52 99.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 484' ' ' PHE . . . . . 0.401 ' HZ ' ' HE1' ' B' ' 468' ' ' PHE . 46.6 t80 -55.74 -42.61 75.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.384 172.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 485' ' ' LEU . . . . . 0.537 ' HB3' HG23 ' A' ' 191' ' ' VAL . 92.1 mt -66.99 -32.97 74.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 486' ' ' ARG . . . . . 0.564 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.2 OUTLIER -59.68 -43.24 94.08 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.113 0.482 . . . . 0.0 110.059 172.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.4 m -60.84 -35.67 77.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.155 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 488' ' ' LEU . . . . . 0.505 HD22 ' CD1' ' A' ' 200' ' ' PHE . 41.9 mt -68.52 -46.17 70.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.586 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.9 m -65.34 -42.06 92.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.555 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 490' ' ' ILE . . . . . 0.567 HD11 ' HE1' ' A' ' 186' ' ' PHE . 11.3 pt -69.98 -29.64 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.926 178.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -68.23 -42.4 79.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.225 0.536 . . . . 0.0 109.789 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -59.24 -41.29 88.41 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.126 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -89.01 18.02 5.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.169 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 54.28 48.19 21.35 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.765 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 495' ' ' VAL . . . . . 0.467 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 83.2 t -98.21 -42.45 11.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.85 175.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 496' ' ' ILE . . . . . 0.421 HG23 ' CG2' ' A' ' 157' ' ' THR . 41.7 pt -115.82 151.23 17.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.695 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 78.2 p -89.84 177.29 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.624 0.249 . . . . 0.0 110.5 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 498' ' ' ARG . . . . . 0.434 ' O ' HG22 ' B' ' 502' ' ' VAL . 22.9 mtm180 -52.38 -54.17 35.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.449 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.66 -48.48 77.5 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.49 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.13 -39.81 75.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.722 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 501' ' ' LEU . . . . . 0.525 HD23 HD23 ' B' ' 523' ' ' LEU . 53.7 tp -62.95 -47.4 83.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 502' ' ' VAL . . . . . 0.453 HG11 ' CE1' ' B' ' 516' ' ' PHE . 0.2 OUTLIER -64.62 -31.3 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.266 0.555 . . . . 0.0 109.923 -179.629 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -67.26 -45.86 75.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.604 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 504' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 153' ' ' LEU . 77.9 mt -64.2 -41.53 97.03 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.37 3.8 3.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.931 0.396 . . . . 0.0 111.113 -178.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 506' ' ' SER . . . . . 0.59 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 22.9 t -55.7 -51.54 79.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 507' ' ' PRO . . . . . 0.59 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 50.4 Cg_exo -57.03 -35.04 98.78 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.877 1.718 . . . . 0.0 112.486 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -73.74 -40.86 63.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.27 -174.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 509' ' ' LEU . . . . . . . . . . . . . 81.2 mt -101.95 4.71 40.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.82 0.343 . . . . 0.0 111.242 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.48 -18.41 69.75 Favored Glycine 0 N--CA 1.455 -0.068 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.766 -177.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 511' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' B' ' 511' ' ' LYS . 2.6 mptp? -93.78 -4.71 49.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.076 0.465 . . . . 0.0 109.79 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 512' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 43.7 m-85 -129.56 87.28 53.35 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.644 -172.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.55 -43.45 58.84 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.229 2.619 . . . . 0.0 113.18 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.69 -44.4 96.58 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.133 0.492 . . . . 0.0 110.709 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 515' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 515' ' ' LEU . 1.4 tp -69.28 -46.61 66.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.423 -173.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 516' ' ' PHE . . . . . 0.491 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 44.5 t80 -66.78 -36.38 82.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.907 0.384 . . . . 0.0 110.623 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.69 -41.55 75.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.545 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 518' ' ' TRP . . . . . 0.421 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 29.3 t90 -55.14 -48.21 74.02 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 175.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 519' ' ' PHE . . . . . 0.509 ' O ' HD12 ' B' ' 523' ' ' LEU . 19.0 t80 -56.99 -46.96 81.87 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.622 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 520' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 83.1 mttt -56.33 -50.42 71.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.259 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.14 -32.81 74.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.452 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -69.15 -44.12 72.96 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.369 0.604 . . . . 0.0 109.5 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 523' ' ' LEU . . . . . 0.525 HD23 HD23 ' B' ' 501' ' ' LEU . 9.7 mp -73.95 -19.72 60.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.674 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.23 13.99 69.94 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 71.7 t80 . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 121.186 0.517 . . . . 0.0 110.455 -175.367 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.0 p . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 120.425 0.155 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 67.38 177.44 0.24 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.535 177.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 64.27 17.01 10.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.944 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -120.86 -18.16 3.99 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.037 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 29.5 m -145.26 165.44 28.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -103.22 11.85 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.709 0.29 . . . . 0.0 111.451 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -70.79 170.78 11.78 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.043 0.449 . . . . 0.0 110.696 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -87.51 137.02 32.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.531 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -99.83 18.8 55.42 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.918 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -107.07 -11.03 26.91 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.331 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 19.4 t70 72.67 -54.93 0.69 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.4 0.68 . . . . 0.0 111.171 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -145.38 119.34 5.5 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 177.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.35 168.59 15.78 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.53 2.153 . . . . 0.0 111.662 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.53 100.48 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.619 0.723 . . . . 0.0 110.693 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -166.64 106.93 0.65 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.78 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -82.36 -5.53 58.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.421 0.629 . . . . 0.0 110.131 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 19.4 mt -93.42 145.52 7.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.406 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.49 ' O ' ' HB ' ' A' ' 145' ' ' THR . 3.4 m-20 -82.77 15.44 2.66 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.854 0.359 . . . . 0.0 110.895 178.718 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' A' ' 144' ' ' ASP . 53.5 m 72.02 112.0 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.324 -174.292 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -59.02 132.79 49.36 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.546 2.164 . . . . 0.0 111.737 -178.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -102.72 138.23 39.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.239 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.68 125.3 40.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.297 0.57 . . . . 0.0 111.277 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.435 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 19.5 t0 -81.81 114.38 20.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.589 174.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.632 HD21 HD12 ' B' ' 504' ' ' LEU . 56.3 mt -100.01 -0.45 39.22 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.335 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -82.66 -19.36 38.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.503 -179.267 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.494 ' NE2' ' HA ' ' B' ' 504' ' ' LEU . 28.8 pt20 -71.01 -26.8 63.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.847 178.309 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.508 HD23 HD13 ' B' ' 504' ' ' LEU . 86.5 mt -65.25 149.21 50.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.687 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -65.73 152.53 44.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.223 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.47 HG21 ' HD3' ' A' ' 175' ' ' LYS . 57.6 t -55.93 -40.1 60.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.309 0.576 . . . . 0.0 109.796 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.84 -39.04 93.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.527 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.0 m -64.21 -44.77 90.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.14 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.07 -41.7 90.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.15 0.5 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.63 -32.39 73.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.418 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.584 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.2 ttm180 -67.47 -44.46 78.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.013 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -51.5 -49.58 61.59 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.063 0.458 . . . . 0.0 110.224 172.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.667 ' HZ2' ' HB3' ' A' ' 162' ' ' LYS . 9.4 mtpm? -63.52 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.884 -178.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -79.89 -39.14 31.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.636 0.255 . . . . 0.0 111.328 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -77.87 -32.82 52.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.96 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -91.06 -4.95 55.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.971 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.8 mptt 56.67 81.78 0.13 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.539 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.416 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 90.3 mt -116.8 95.36 46.33 Favored Pre-proline 0 C--N 1.325 -0.466 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . 0.416 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 21.0 Cg_endo -61.73 127.27 21.1 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.798 2.332 . . . . 0.0 111.405 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 10.8 p -137.76 177.72 7.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.221 -174.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . 0.412 ' HA ' ' HD3' ' A' ' 171' ' ' PRO . 94.1 mtt180 -93.39 146.2 31.41 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.861 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 24.7 Cg_exo -63.77 146.24 91.74 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.761 2.307 . . . . 0.0 111.908 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.15 7.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.314 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.38 145.08 44.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.948 0.404 . . . . 0.0 111.297 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.568 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 13.9 m120 -121.42 174.96 6.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.258 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.62 ' O ' HG22 ' A' ' 179' ' ' VAL . 20.7 tptm -54.88 -53.1 59.8 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.473 0.483 . . . . 0.0 111.371 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.38 -39.01 85.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.675 0.274 . . . . 0.0 111.196 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -62.12 -46.29 89.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.271 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.568 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 84.7 mt -59.05 -49.68 76.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.62 HG22 ' O ' ' A' ' 175' ' ' LYS . 39.0 t -58.73 -40.54 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.344 -176.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -64.72 -49.17 71.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.929 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.32 -47.82 88.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.821 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.24 -47.71 89.4 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.177 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . 0.503 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -62.45 -38.96 97.18 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.671 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.46 -41.94 99.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -81.04 -31.6 34.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.651 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.98 -27.87 69.13 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 122.87 0.468 . . . . 0.0 110.922 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 63.5 mttp -72.8 -6.71 46.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.34 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.9 t -133.09 60.74 1.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 110.704 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.967 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 68.8 mt -110.75 119.0 47.37 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.169 175.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.01 129.24 19.12 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.074 2.516 . . . . 0.0 111.214 175.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.0 p -142.45 154.65 18.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.696 -173.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.42 122.01 21.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.628 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 29.0 tt0 -48.79 -64.13 0.89 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.413 0.445 . . . . 0.0 112.146 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -56.86 -53.04 62.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -172.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -66.88 -42.13 86.09 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.712 -176.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.7 m -64.92 -40.79 95.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.978 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 52.5 mt -63.38 -43.9 96.29 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 53.9 m -58.58 -48.99 79.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.097 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 74.7 m -58.36 -48.73 79.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.863 0.364 . . . . 0.0 110.704 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.521 ' CD1' HD21 ' B' ' 488' ' ' LEU . 42.2 t80 -57.33 -55.65 32.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.079 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.488 HD13 ' HE2' ' B' ' 468' ' ' PHE . 85.4 mt -57.64 -45.48 86.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.243 0.544 . . . . 0.0 110.57 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.88 -59.83 4.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.191 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 68.8 m -62.36 -45.4 93.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -174.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.477 HG12 HD22 ' B' ' 523' ' ' LEU . 51.6 t -67.39 -35.32 73.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.37 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -77.46 -13.89 59.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.109 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -103.48 -80.58 0.52 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.979 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.42 107.0 11.95 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.857 0.836 . . . . 0.0 111.097 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -75.46 90.03 2.69 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.434 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 7.5 t30 63.77 85.82 0.13 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.369 -178.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.588 ' HE2' ' HB2' ' A' ' 212' ' ' ASP . 87.2 tttt -81.71 139.3 34.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.701 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 5.8 p -80.03 -73.75 0.34 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 121.197 -0.201 . . . . 0.0 110.73 -179.161 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.588 ' HB2' ' HE2' ' A' ' 210' ' ' LYS . 30.0 t70 47.06 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.516 0.674 . . . . 0.0 112.003 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.88 108.75 14.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.744 -177.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -151.6 135.42 16.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.232 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -91.03 129.26 37.05 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.777 0.322 . . . . 0.0 110.201 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -84.7 -71.48 0.52 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.457 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 8.2 m -83.67 115.89 22.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.803 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -78.8 75.77 1.97 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.939 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 11.2 p -74.85 -29.42 22.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.039 0.447 . . . . 0.0 110.703 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.643 -0.694 . . . . 0.0 109.615 179.875 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 48.0 m . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 120.544 0.212 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 11.9 m120 61.84 27.57 16.82 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.034 175.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -99.03 -75.31 0.56 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.724 0.297 . . . . 0.0 110.97 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 7.7 p -90.71 34.42 0.9 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 111.066 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -101.98 -71.69 0.71 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.184 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -113.72 -36.64 4.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 -176.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -73.32 -72.74 0.95 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.286 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . 0.637 HG13 ' HB2' ' B' ' 464' ' ' GLU . 71.0 t -81.35 120.64 33.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.715 0.293 . . . . 0.0 110.344 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -133.1 -67.69 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.342 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 463' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 11.6 t -74.46 -25.39 59.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.13 0.491 . . . . 0.0 110.398 -178.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.637 ' HB2' HG13 ' B' ' 461' ' ' VAL . 2.9 mp0 -66.6 -44.0 83.29 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 176.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 10.7 t -65.24 -33.28 75.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.43 ' HB3' ' O ' ' B' ' 463' ' ' THR . 53.9 tp -60.73 -49.22 78.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.992 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.482 ' O ' HG23 ' B' ' 471' ' ' VAL . 78.1 t80 -55.78 -51.74 66.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.364 176.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.488 ' HE2' HD13 ' A' ' 201' ' ' ILE . 30.7 m-85 -65.45 -34.97 79.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.535 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.62 -45.44 94.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -58.85 -48.75 80.26 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.812 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.482 HG23 ' O ' ' B' ' 467' ' ' PHE . 63.3 t -58.92 -47.07 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.875 0.369 . . . . 0.0 110.658 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -39.37 90.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -79.85 -30.77 40.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.196 -175.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.447 ' HB2' ' CE2' ' B' ' 512' ' ' PHE . . . -80.0 -47.69 14.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.611 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 24.9 mt -66.53 -40.39 89.11 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.371 -178.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 71.25 -46.05 0.63 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.525 0.73 . . . . 0.0 112.692 173.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 33.8 t -72.13 136.68 46.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.671 0.272 . . . . 0.0 110.493 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.82 97.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.823 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.55 -29.65 64.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.462 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -68.34 -42.38 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.408 . . . . 0.0 110.425 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -67.48 -37.36 82.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.544 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 44.6 tt0 -60.26 -42.1 94.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 174.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.462 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 19.5 t-20 -53.59 -49.16 68.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.277 176.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -54.07 -47.69 71.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.29 0.567 . . . . 0.0 110.507 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.01 -31.62 72.29 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.134 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.967 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 17.1 mtt85 -67.49 -37.55 83.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.39 . . . . 0.0 110.258 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.4 m -62.17 -36.37 81.67 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.521 HD21 ' CD1' ' A' ' 200' ' ' PHE . 34.4 mt -66.46 -47.43 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.287 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.464 HG23 ' HA ' ' B' ' 486' ' ' ARG . 12.6 m -64.7 -42.45 95.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.756 -0.377 . . . . 0.0 111.902 -177.371 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.416 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 26.1 pt -69.22 -31.27 49.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.988 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -63.96 -45.74 87.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -64.49 -35.94 82.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -81.92 17.57 1.52 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.693 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 64.22 29.54 13.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 111.064 172.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.584 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 95.8 t -93.33 -55.12 6.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.377 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 41.3 pt -104.35 149.49 8.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.802 -0.359 . . . . 0.0 111.194 -176.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.401 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.1 m -78.64 173.77 12.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.512 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -57.78 -58.82 6.7 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.219 0.533 . . . . 0.0 111.076 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . 0.648 ' HA ' HG22 ' B' ' 502' ' ' VAL . . . -60.81 -38.04 84.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.933 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.401 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 7.9 mm-40 -56.4 -38.3 71.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.195 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.9 tp -64.84 -52.46 56.56 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.942 177.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.648 HG22 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -62.72 -40.66 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.929 -178.773 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -67.48 -37.74 83.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.422 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.632 HD12 HD21 ' A' ' 150' ' ' LEU . 10.7 tp -62.37 -41.78 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.746 0.308 . . . . 0.0 111.181 -174.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 18.0 m -86.11 14.24 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.855 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 48.3 t -57.53 -51.41 81.91 Favored Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 178.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.1 Cg_exo -61.38 -8.42 10.58 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.137 1.891 . . . . 0.0 112.738 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.58 -61.5 1.52 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.302 -177.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.461 HD22 HG11 ' B' ' 471' ' ' VAL . 46.4 mt -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.364 -173.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.62 68.43 Favored Glycine 0 N--CA 1.454 -0.118 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.744 -176.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.29 0.567 . . . . 0.0 110.185 178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.46 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 45.7 m-85 -115.76 98.11 50.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.244 -175.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . 0.46 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.8 Cg_endo -54.17 -46.36 34.16 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.398 2.732 . . . . 0.0 113.211 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -61.81 -38.5 88.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.175 0.512 . . . . 0.0 110.892 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.48 -47.09 35.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.546 -176.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.594 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 11.8 t80 -69.36 -32.22 71.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.738 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -70.14 -40.32 74.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.226 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -54.84 -48.36 72.98 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.593 ' O ' ' HG ' ' B' ' 523' ' ' LEU . 8.4 t80 -56.79 -49.71 74.53 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.652 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.594 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 94.8 mttt -59.01 -44.74 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.529 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -64.14 -35.24 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.812 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -71.79 -38.9 70.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.569 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' B' ' 519' ' ' PHE . 68.0 mt -77.1 -13.45 59.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.221 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 70.36 43.46 62.3 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -173.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -81.61 98.22 8.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.987 0.422 . . . . 0.0 109.998 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -67.73 -76.19 0.09 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.323 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 58.76 19.08 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.533 -177.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 C--O 1.247 0.964 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.71 -176.859 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 65.66 -176.77 0.18 Allowed 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.023 0.529 . . . . 0.0 111.177 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -157.14 -169.26 2.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.07 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -88.68 -148.36 16.94 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.176 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.6 p -95.06 -3.65 47.81 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.364 0.602 . . . . 0.0 109.902 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -122.34 131.13 53.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.415 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -107.75 103.94 13.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.109 0.481 . . . . 0.0 110.564 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -107.57 112.17 24.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.062 178.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -165.69 101.86 0.19 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.104 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -156.12 80.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -69.58 -40.63 76.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.749 0.309 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 9.3 t -149.86 106.46 3.23 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.68 125.01 11.69 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.677 2.251 . . . . 0.0 112.168 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 33.2 m -74.77 155.79 6.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.781 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -101.63 77.23 1.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.337 0.589 . . . . 0.0 109.746 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -83.93 -28.52 27.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.895 -177.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.429 HG22 ' O ' ' A' ' 143' ' ' ILE . 36.1 mt 72.81 11.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.443 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.586 ' O ' ' HB ' ' A' ' 145' ' ' THR . 28.5 t70 59.93 10.07 2.0 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.734 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' THR . . . . . 0.586 ' HB ' ' O ' ' A' ' 144' ' ' ASP . 25.0 m 73.45 110.5 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.434 -172.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.418 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 32.4 Cg_exo -57.07 136.29 75.76 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 111.392 174.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -110.06 166.07 11.23 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.667 -176.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.526 HG11 ' ND2' ' B' ' 483' ' ' ASN . 6.8 p -114.01 140.48 34.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.861 176.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 12.5 t70 -106.33 124.52 49.72 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.415 HD11 HG13 ' A' ' 182' ' ' VAL . 61.7 mt -104.05 2.53 32.25 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.393 0.616 . . . . 0.0 110.624 -177.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -86.39 -21.92 26.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.758 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 19.0 pt20 -73.34 -17.57 61.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.835 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.491 HD12 HD22 ' B' ' 504' ' ' LEU . 76.2 mt -75.1 173.1 11.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.269 0.557 . . . . 0.0 111.621 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -87.6 144.8 26.5 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.33 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.538 HG11 ' CD1' ' A' ' 178' ' ' LEU . 55.3 t -54.08 -42.26 54.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.516 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.69 -35.41 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.145 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.6 m -69.83 -42.02 74.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.767 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.47 ' O ' ' HG3' ' A' ' 162' ' ' LYS . 74.7 mt -64.56 -40.94 96.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.226 178.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 159' ' ' ARG . 27.9 mtp85 -64.71 -37.42 87.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.594 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.435 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 35.2 ttm105 -66.25 -38.85 88.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.446 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.488 ' HA ' HG11 ' B' ' 495' ' ' VAL . 60.4 t80 -56.44 -51.52 68.08 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.275 172.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.61 ' HZ1' ' HB2' ' A' ' 167' ' ' LEU . 7.4 mtpm? -60.97 -35.19 76.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.457 -177.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -76.43 -34.91 58.76 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.929 -176.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -77.16 -42.4 37.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.338 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.421 ' CE1' HG23 ' B' ' 490' ' ' ILE . 58.2 m-85 -89.63 3.01 53.96 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.465 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 54.5 74.57 0.34 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.7 0.625 . . . . 0.0 111.307 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.61 ' HB2' ' HZ1' ' A' ' 162' ' ' LYS . 84.8 mt -111.05 144.56 30.64 Favored Pre-proline 0 C--N 1.328 -0.353 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.093 -177.329 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.47 162.58 33.26 Favored 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.041 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.5 p -140.88 179.01 6.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.949 0.404 . . . . 0.0 111.286 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -144.84 145.69 28.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -57.52 128.25 28.61 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.667 2.244 . . . . 0.0 112.177 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 99.24 39.38 3.51 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.136 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 75.2 mt -65.76 155.4 36.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.122 0.486 . . . . 0.0 111.337 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.405 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 8.2 t-20 -154.63 -171.67 3.93 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.642 ' O ' HG22 ' A' ' 179' ' ' VAL . 19.4 tptm -64.09 -62.1 1.84 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.731 0.241 . . . . 0.0 111.251 -176.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.21 -30.13 64.3 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.701 0.286 . . . . 0.0 111.383 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.405 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 8.9 mm-40 -59.02 -55.29 37.1 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.67 0.748 . . . . 0.0 110.393 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.538 ' CD1' HG11 ' A' ' 155' ' ' VAL . 53.4 mt -64.29 -41.56 96.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.661 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.642 HG22 ' O ' ' A' ' 175' ' ' LYS . 23.6 t -60.48 -37.92 76.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.773 -178.127 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.99 -53.26 48.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.874 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 55.3 mt -60.32 -49.33 84.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 121.01 0.433 . . . . 0.0 110.744 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.415 HG13 HD11 ' A' ' 150' ' ' LEU . 77.5 t -59.17 -49.09 84.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.939 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.58 -37.32 94.0 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.439 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 29.1 t -61.97 -42.36 99.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.93 0.395 . . . . 0.0 110.907 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 -87.26 -25.11 24.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.387 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.422 ' HE1' HD11 ' B' ' 490' ' ' ILE . 73.9 t80 -62.22 -43.58 98.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.104 0.478 . . . . 0.0 110.651 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -80.94 8.13 9.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.566 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 3.2 p -125.12 14.18 8.4 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.805 0.336 . . . . 0.0 111.274 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.415 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 75.6 mt -79.58 120.75 81.24 Favored Pre-proline 0 C--O 1.235 0.321 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.55 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.99 115.96 4.49 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.994 2.463 . . . . 0.0 111.294 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.455 HG22 ' HB3' ' B' ' 485' ' ' LEU . 3.8 p -127.89 156.21 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.068 -174.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.502 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 18.9 m120 -128.97 138.33 51.89 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.716 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 27.1 tt0 -55.54 -67.28 0.3 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -72.7 -36.47 67.84 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.777 0.322 . . . . 0.0 110.965 -172.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . 0.502 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 12.1 t70 -55.25 -49.6 71.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.993 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 90.4 m -75.54 -35.35 60.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.501 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 35.7 mt -58.45 -46.62 86.17 Favored 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.9 m -61.49 -43.53 98.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.0 m -58.08 -50.99 71.54 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.875 0.369 . . . . 0.0 111.013 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.45 ' CD1' HD21 ' B' ' 488' ' ' LEU . 76.2 t80 -65.1 -47.13 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.574 -175.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 197' ' ' LEU . 77.5 mt -61.95 -45.71 98.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.034 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -66.42 -35.96 81.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.496 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.9 m -62.41 -61.33 2.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.628 HG11 ' HG2' ' A' ' 208' ' ' LYS . 99.4 t -61.91 -39.71 84.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.855 -174.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -73.59 -9.7 58.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.742 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.23 -72.15 0.73 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.878 0.37 . . . . 0.0 110.214 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -144.55 116.46 8.29 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 174.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.628 ' HG2' HG11 ' A' ' 204' ' ' VAL . 85.4 mttt -70.81 -56.51 6.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.884 -168.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 179.67 117.52 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.42 145.31 18.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.252 0.548 . . . . 0.0 111.523 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 211' ' ' SER . . . . . 0.593 ' HB3' ' HB3' ' A' ' 214' ' ' LYS . 15.7 m -137.52 112.14 8.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.213 -175.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -106.98 120.92 43.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 34.1 tp 61.59 64.12 1.09 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.625 0.726 . . . . 0.0 109.438 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . 0.8 ' HD3' ' H ' ' A' ' 214' ' ' LYS . 0.0 OUTLIER -98.27 -50.09 4.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.214 -171.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . 0.428 ' N ' ' HG2' ' A' ' 214' ' ' LYS . . . -173.36 -50.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.507 0.194 . . . . 0.0 111.071 -174.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 67.38 27.26 8.2 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.224 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.5 m -129.19 151.5 49.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.452 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 101.62 -140.11 14.72 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.5 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 26.8 m -111.84 -7.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.986 0.422 . . . . 0.0 110.851 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.021 -179.27 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.83 0.348 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -82.14 -40.38 21.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.085 0.469 . . . . 0.0 110.049 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.65 167.18 13.6 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.743 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 39.9 t -114.39 140.9 48.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.7 0.286 . . . . 0.0 110.436 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -75.42 -42.89 52.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.3 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -85.6 -29.31 24.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.811 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 89.65 -50.32 3.49 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.863 176.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 27.3 m -117.75 161.29 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.844 0.354 . . . . 0.0 111.137 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -157.51 50.84 0.42 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.655 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.5 t -70.37 -23.35 62.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.492 0.187 . . . . 0.0 111.329 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -63.59 -53.63 48.59 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -60.67 -33.45 72.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.606 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.32 -50.7 71.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.247 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.452 ' O ' HG22 ' B' ' 471' ' ' VAL . 59.5 t80 -52.62 -51.31 60.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.774 175.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.41 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 60.4 m-85 -65.02 -34.61 78.83 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.53 -38.16 88.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.935 0.398 . . . . 0.0 110.134 176.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -63.95 -47.06 81.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.223 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.469 HG12 HD21 ' B' ' 509' ' ' LEU . 75.2 t -58.74 -45.24 91.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 110.465 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -59.33 -38.06 79.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -79.01 -41.38 29.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.183 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.53 ' HB2' ' CE2' ' B' ' 512' ' ' PHE . . . -67.27 -43.41 81.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.184 -174.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.02 -30.65 69.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.095 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 69.23 -59.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.526 0 O-C-N 123.942 0.776 . . . . 0.0 112.104 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 32.8 t -69.06 135.09 50.26 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.238 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.17 81.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.245 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.27 -39.24 82.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.259 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.418 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.31 -45.85 89.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.104 0.478 . . . . 0.0 110.326 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.419 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 55.3 t80 -66.81 -31.5 72.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.113 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.647 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 33.5 tt0 -65.49 -42.94 91.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.668 176.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.526 ' ND2' HG11 ' A' ' 148' ' ' VAL . 5.5 m-20 -55.67 -46.28 77.58 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.817 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -55.94 -46.79 78.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.455 ' HB3' HG22 ' A' ' 191' ' ' VAL . 90.5 mt -67.73 -32.69 73.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.647 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -61.3 -41.33 96.8 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 120.815 0.341 . . . . 0.0 110.183 173.381 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.6 m -62.48 -35.49 79.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.224 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.45 HD21 ' CD1' ' A' ' 200' ' ' PHE . 40.2 mt -68.51 -47.19 67.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.435 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.5 m -65.33 -40.81 89.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.665 -177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.437 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.8 pt -69.44 -32.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.735 178.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -65.18 -42.79 93.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.21 0.529 . . . . 0.0 109.727 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.19 -38.23 82.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.87 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -86.79 15.95 5.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.475 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 60.5 26.34 15.98 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.752 0.421 . . . . 0.0 111.631 177.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.488 HG11 ' HA ' ' A' ' 161' ' ' TYR . 53.6 t -77.13 -48.48 24.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.537 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 38.4 pt -113.3 155.58 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.997 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.436 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 81.4 p -96.27 -173.32 2.76 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -54.88 -59.54 4.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.0 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.6 -40.51 83.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.962 -173.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.537 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 6.7 mm-40 -59.19 -44.0 92.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.425 0.631 . . . . 0.0 109.908 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.508 HD21 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -62.3 -46.07 90.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.226 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.2 -32.9 59.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.728 -178.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -71.57 -39.9 70.29 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.331 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.491 HD22 HD12 ' A' ' 153' ' ' LEU . 74.9 mt -65.05 -38.73 91.76 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.885 0.374 . . . . 0.0 111.891 -177.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 34.9 m -84.92 11.41 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.583 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.637 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 43.8 t -61.03 -52.21 73.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.865 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.637 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 32.2 Cg_exo -63.61 -15.93 51.62 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.898 1.732 . . . . 0.0 112.378 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.417 ' CD2' ' HB2' ' A' ' 146' ' ' PRO . 94.9 m-85 -90.56 -65.73 0.99 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.082 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.469 HD21 HG12 ' B' ' 471' ' ' VAL . 87.9 mt -92.33 -5.13 52.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.438 -173.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.64 -17.1 68.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.431 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -72.57 -21.1 61.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 176.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.53 ' CE2' ' HB2' ' B' ' 474' ' ' ALA . 22.6 m-85 -123.28 86.47 51.71 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.682 -176.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.7 -46.49 29.73 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 123.155 2.57 . . . . 0.0 113.185 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -65.07 -37.55 87.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.871 0.367 . . . . 0.0 111.249 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 20.7 tp -70.4 -38.73 74.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.296 0.57 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.591 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 54.0 t80 -65.38 -35.39 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.828 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -70.01 -32.86 71.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.057 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -59.14 -48.85 80.07 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -56.28 -46.7 79.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.522 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.591 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 92.6 mttt -60.64 -41.01 94.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.186 176.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -61.58 -30.56 70.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -75.92 -39.32 56.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.286 0.565 . . . . 0.0 109.928 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.508 HD21 HD21 ' B' ' 501' ' ' LEU . 10.2 mp -80.76 -24.64 38.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.074 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 95.03 30.55 8.24 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.787 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -86.4 92.95 8.99 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 1.8 tppp? -95.65 28.04 3.19 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.403 -176.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 60.82 25.68 15.56 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.308 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 51.5 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.145 179.719 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 p . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 120.472 0.177 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 63.0 25.84 15.23 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -86.3 108.02 18.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.373 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 171.77 179.6 42.87 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.789 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 34.8 t -144.74 163.74 33.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.866 0.365 . . . . 0.0 110.533 -177.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -100.26 -1.67 35.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.906 176.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 134' ' ' ASP . 3.6 p-10 42.27 -101.42 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.06 178.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.449 ' H ' ' CG ' ' A' ' 133' ' ' ASP . 33.5 t70 54.29 79.06 0.14 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.445 0.64 . . . . 0.0 110.603 -177.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.88 -74.49 0.46 Allowed Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.455 -176.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 95.34 46.24 2.83 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.697 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -72.47 108.73 5.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.938 0.399 . . . . 0.0 110.447 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.513 ' HB2' ' HB3' ' A' ' 141' ' ' GLN . 14.8 m -83.97 131.15 52.31 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.098 -178.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.68 -55.43 3.55 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.746 2.297 . . . . 0.0 111.868 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . 0.95 ' HB ' ' HG2' ' B' ' 511' ' ' LYS . 39.0 t -116.53 103.33 14.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.513 ' HB3' ' HB2' ' A' ' 138' ' ' SER . 26.8 pt20 -128.52 -179.57 5.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.326 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 24.0 t70 64.91 101.92 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.872 0.733 . . . . 0.0 110.987 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.478 ' O ' ' HD3' ' B' ' 476' ' ' ARG . 0.7 OUTLIER -148.38 137.38 15.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.217 -177.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.431 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.8 t70 -111.45 -47.77 3.15 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 34.1 m -151.73 96.02 3.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.916 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.05 155.12 57.48 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.187 1.925 . . . . 0.0 111.737 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.29 137.04 51.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.131 0.491 . . . . 0.0 111.714 -172.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.46 133.59 28.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.086 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -87.38 -26.81 23.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.215 0.531 . . . . 0.0 111.109 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 74.6 mt 64.15 13.77 8.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.227 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.14 -16.03 34.53 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.05 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.8 -15.08 60.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.328 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.401 HD22 HG22 ' A' ' 157' ' ' THR . 81.2 mt -67.44 140.4 57.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.53 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.19 157.83 36.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.797 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 88.7 t -56.16 -44.17 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.855 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -64.31 -36.58 84.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.808 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.401 HG22 HD22 ' A' ' 153' ' ' LEU . 10.4 m -63.58 -46.58 85.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.629 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.428 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 68.5 mt -62.48 -42.73 99.69 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.743 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 66.4 mtp85 -70.08 -28.81 65.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.499 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 33.7 ttm180 -72.34 -44.6 62.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.499 ' HH ' HD12 ' A' ' 189' ' ' ILE . 57.7 t80 -51.98 -51.22 58.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.081 172.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.938 ' HZ3' HG23 ' A' ' 181' ' ' ILE . 19.8 mtpp -65.97 -29.73 70.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.279 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -81.84 -42.67 19.29 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.701 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 -68.39 -32.77 73.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.874 -175.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -95.7 0.11 52.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.151 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 57.64 77.53 0.27 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.016 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 77.0 mt -120.67 134.85 24.31 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.78 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.75 155.15 65.23 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.908 2.405 . . . . 0.0 113.114 -173.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.632 ' HB ' HD11 ' A' ' 173' ' ' LEU . 67.8 p -138.56 -179.56 5.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.358 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.5 ppt_? -165.18 159.26 14.35 Favored Pre-proline 0 C--N 1.327 -0.41 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.38 131.5 45.63 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.75 2.3 . . . . 0.0 112.557 179.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 108.05 31.67 3.52 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.632 HD11 ' HB ' ' A' ' 169' ' ' THR . 79.6 mt -80.92 140.15 35.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.217 0.532 . . . . 0.0 111.008 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.514 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 93.2 m-20 -131.11 172.95 11.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.184 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.582 ' O ' HG21 ' A' ' 179' ' ' VAL . 21.5 tptm -56.39 -53.9 51.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.353 0.408 . . . . 0.0 110.339 176.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . 0.583 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -62.05 -34.21 75.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.423 -178.715 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.514 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.6 mm100 -67.03 -41.74 86.06 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.032 0.444 . . . . 0.0 110.879 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 88.0 mt -61.22 -47.87 84.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.837 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.582 HG21 ' O ' ' A' ' 175' ' ' LYS . 35.6 t -60.19 -32.61 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.801 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 13.2 mm-40 -61.97 -57.45 11.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 110.691 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.938 HG23 ' HZ3' ' A' ' 162' ' ' LYS . 38.6 mt -61.69 -43.2 96.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.676 -178.147 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 178' ' ' LEU . 71.8 t -59.64 -49.0 85.35 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.316 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.2 -40.86 99.54 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.314 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 41.2 t -55.85 -42.73 76.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 111.195 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -86.38 -30.49 22.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.873 0.368 . . . . 0.0 111.3 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.41 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 64.2 t80 -63.87 -32.01 73.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.145 -177.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.63 14.64 1.59 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.54 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 43.0 m -147.45 34.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.692 0.282 . . . . 0.0 111.457 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.903 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 72.4 mt -93.31 114.92 64.16 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.752 -0.203 . . . . 0.0 110.613 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.29 127.24 18.69 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.67 2.247 . . . . 0.0 110.892 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 9.0 p -144.61 149.76 16.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.739 -174.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.669 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 12.6 m-80 -112.52 155.42 24.34 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.1 tt0 -71.64 -66.68 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -178.042 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -73.49 -43.79 59.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.253 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . 0.669 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 15.0 t70 -52.64 -48.4 66.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.998 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 36.7 m -71.3 -42.76 68.25 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.338 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 55.0 mt -56.8 -45.94 81.91 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.147 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 18.2 m -62.19 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.906 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 79.4 m -59.8 -49.86 76.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.865 0.364 . . . . 0.0 110.918 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.535 ' O ' HG21 ' A' ' 204' ' ' VAL . 76.6 t80 -60.86 -55.31 34.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.826 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.49 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 76.0 mt -54.35 -50.41 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.669 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -58.34 -43.34 88.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.782 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 -43.82 92.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.488 -179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.535 HG21 ' O ' ' A' ' 200' ' ' PHE . 17.8 t -73.5 -22.29 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-O 121.34 0.591 . . . . 0.0 110.562 -178.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 9.9 mmm180 -69.4 -32.05 70.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.138 172.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -84.98 -54.07 4.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.908 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.514 ' OD1' ' HA ' ' A' ' 211' ' ' SER . 11.4 t70 -141.8 -162.01 1.32 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.479 ' H ' ' CG ' ' A' ' 207' ' ' ASP . 32.8 mmtp -112.68 -16.64 12.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -154.42 -49.52 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.579 176.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -175.52 124.56 0.23 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.657 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 211' ' ' SER . . . . . 0.514 ' HA ' ' OD1' ' A' ' 207' ' ' ASP . 73.2 m -57.09 104.23 0.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.521 0.676 . . . . 0.0 112.037 -173.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -102.88 -70.57 0.75 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.777 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . 0.463 ' HB3' ' HD3' ' A' ' 214' ' ' LYS . 51.4 tp 179.43 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.128 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . 0.463 ' HD3' ' HB3' ' A' ' 213' ' ' LEU . 0.0 OUTLIER -131.36 51.54 2.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.809 -178.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -79.19 -18.38 53.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.689 0.757 . . . . 0.0 110.086 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.1 -52.25 7.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.368 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 47.5 t -170.58 -60.83 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.814 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 72.39 -79.39 0.66 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.503 -176.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 15.0 p -124.18 -20.53 3.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.98 0.419 . . . . 0.0 110.22 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.425 -0.798 . . . . 0.0 110.25 -177.805 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 120.93 0.395 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -100.18 119.04 37.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.129 175.277 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -81.98 166.65 19.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.392 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 34.9 t -84.3 10.13 11.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.311 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 60.8 mttm 61.6 -153.27 0.36 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.24 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -128.86 132.56 47.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.875 0.369 . . . . 0.0 110.792 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 135.44 104.69 0.78 Allowed Glycine 0 N--CA 1.445 -0.735 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.632 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 32.7 m -80.65 -25.51 11.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.804 0.335 . . . . 0.0 110.864 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 134.12 -167.77 23.61 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.03 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.2 p -64.97 -15.71 62.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.989 0.423 . . . . 0.0 111.64 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.567 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.4 mp0 -57.17 -36.01 70.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.73 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 31.8 t -61.17 -43.04 99.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.224 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.426 HD23 ' C ' ' B' ' 466' ' ' LEU . 9.4 tt -62.75 -46.01 90.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.728 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.558 ' O ' HG21 ' B' ' 471' ' ' VAL . 81.5 t80 -52.88 -59.53 4.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.543 177.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.443 ' HE2' HD11 ' A' ' 201' ' ' ILE . 51.3 m-85 -65.18 -36.21 83.49 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -174.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.47 -45.18 94.21 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . 0.405 ' HD2' HD11 ' B' ' 515' ' ' LEU . 23.6 ttmm -67.8 -40.85 83.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.637 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.558 HG21 ' O ' ' B' ' 467' ' ' PHE . 77.2 t -56.21 -48.6 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.903 0.383 . . . . 0.0 110.462 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 1.5 tmt_? -57.07 -45.21 83.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.381 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -76.94 -37.04 56.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.666 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -69.61 -41.08 76.19 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -176.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.13 -32.56 73.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.422 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . 0.478 ' HD3' ' O ' ' A' ' 143' ' ' ILE . 40.2 ttt180 69.28 -1.63 2.11 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.875 0.735 . . . . 0.0 111.875 173.169 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 21.4 t -127.14 131.31 50.79 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.23 -35.66 80.04 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.106 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.01 -37.87 81.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.342 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.24 -37.5 78.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.859 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -68.87 -37.69 79.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.003 0.43 . . . . 0.0 109.907 177.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.9 tt0 -61.37 -42.44 98.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.474 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 1.7 t-20 -52.21 -51.41 58.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.036 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.494 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 87.8 t80 -52.71 -47.62 67.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.682 177.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.03 -33.31 75.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.203 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.903 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.8 mtt180 -66.37 -37.74 85.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 176.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 84.1 m -61.18 -36.3 79.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.864 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.535 HD22 ' CG ' ' A' ' 200' ' ' PHE . 62.0 mt -68.89 -45.84 69.93 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.566 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.474 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -64.62 -42.31 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.478 -178.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.427 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 17.6 pt -69.18 -32.02 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.608 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.85 -44.3 90.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.079 0.466 . . . . 0.0 109.987 172.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -68.85 -16.68 63.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.831 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -101.37 16.49 25.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.27 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 65.56 10.84 6.99 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.425 0.453 . . . . 0.0 111.647 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.499 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 78.9 t -70.55 -47.22 66.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.915 0.388 . . . . 0.0 110.807 -176.703 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.6 pt -112.07 179.71 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.182 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.496 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.0 m -119.8 170.95 8.77 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.057 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.509 ' O ' HG22 ' B' ' 502' ' ' VAL . 55.6 ttp180 -50.57 -56.52 11.37 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.519 0.512 . . . . 0.0 111.384 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.34 -43.65 83.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.336 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.496 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 12.4 mm-40 -56.01 -49.0 74.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.362 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.463 HD22 ' C ' ' B' ' 501' ' ' LEU . 8.9 tt -61.64 -46.27 90.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.765 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.509 HG22 ' O ' ' B' ' 498' ' ' ARG . 90.2 t -59.76 -36.69 67.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -82.32 -27.12 32.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.468 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 20.7 mt -65.0 -43.19 93.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.004 0.43 . . . . 0.0 111.528 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.495 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.4 p -84.63 11.51 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.108 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.45 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 32.9 t -59.73 -50.07 88.61 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.158 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.459 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 11.5 Cg_endo -60.56 -8.2 8.56 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.255 1.97 . . . . 0.0 113.308 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.459 ' CE2' ' HG2' ' B' ' 507' ' ' PRO . 65.9 m-85 -110.45 -61.38 1.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.249 -175.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.566 HD22 HD23 ' B' ' 515' ' ' LEU . 74.7 mt -96.93 -14.79 21.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.807 -0.179 . . . . 0.0 111.474 -174.54 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.8 -19.04 64.9 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.668 -176.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.95 ' HG2' ' HB ' ' A' ' 140' ' ' VAL . 8.0 mtpt -85.73 -3.81 59.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.694 0.283 . . . . 0.0 110.812 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.431 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 74.0 m-85 -122.98 95.11 46.57 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.69 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . 0.431 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 8.2 Cg_endo -51.24 -50.75 12.92 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.21 2.606 . . . . 0.0 113.1 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.73 -39.17 87.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.9 0.381 . . . . 0.0 111.577 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.566 HD23 HD22 ' B' ' 509' ' ' LEU . 14.6 tp -78.13 -41.38 35.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 -173.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -66.96 -39.25 87.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.681 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.84 -36.19 83.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.567 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 8.7 t90 -59.4 -49.03 79.37 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.438 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.3 OUTLIER -62.48 -42.66 99.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.627 -177.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -61.96 -40.15 94.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.793 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -63.42 -47.61 81.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.049 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.91 -35.18 79.92 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.01 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.52 -9.23 58.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.657 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.08 41.18 61.04 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.203 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . 0.498 ' CE2' ' HB2' ' B' ' 527' ' ' GLU . 65.8 t80 -80.53 105.86 12.1 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -59.82 -71.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.715 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . 0.498 ' HB2' ' CE2' ' B' ' 525' ' ' TYR . 43.4 tt0 64.58 92.03 0.07 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.149 -177.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.459 179.239 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 69.02 83.96 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 O-C-N 123.74 0.65 . . . . 0.0 110.35 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -104.94 -22.75 13.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.435 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 172.27 102.66 0.16 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.839 -0.696 . . . . 0.0 111.738 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.2 m -75.58 -50.47 15.47 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.16 90.49 0.03 OUTLIER 'General case' 0 C--O 1.235 0.34 0 O-C-N 124.157 0.911 . . . . 0.0 111.985 177.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.08 -37.61 86.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.542 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -169.35 115.47 0.58 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.285 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -171.98 49.54 0.18 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.032 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -177.47 79.25 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.075 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -99.22 141.11 32.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.02 0.438 . . . . 0.0 110.537 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.43 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 24.4 m -96.63 119.87 63.08 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.445 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 5.5 Cg_exo -77.86 -159.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 123.16 2.573 . . . . 0.0 112.006 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.9 m -82.2 17.79 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.028 0.442 . . . . 0.0 111.168 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -170.24 -170.12 0.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.8 t70 65.67 86.59 0.13 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.395 0.616 . . . . 0.0 110.093 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.533 HG23 ' HG3' ' A' ' 146' ' ' PRO . 1.4 mp -77.59 143.19 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.424 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' B' ' 477' ' ' SER . 10.2 t70 -90.94 -60.45 1.91 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 37.7 m -157.31 110.36 1.87 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.094 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.533 ' HG3' HG23 ' A' ' 143' ' ' ILE . 2.6 Cg_exo -75.61 163.37 34.1 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.543 2.162 . . . . 0.0 111.829 176.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -114.78 154.23 28.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.472 -178.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.759 HG13 HD22 ' B' ' 483' ' ' ASN . 3.7 p -112.17 135.61 50.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.365 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -101.15 133.65 45.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.155 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.416 HD12 HG13 ' A' ' 182' ' ' VAL . 64.7 mt -114.82 3.31 14.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.65 0.738 . . . . 0.0 110.117 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -28.76 40.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.43 -0.804 . . . . 0.0 108.956 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.422 ' HG3' ' N ' ' A' ' 153' ' ' LEU . 3.7 pt20 -59.13 -32.05 69.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.475 175.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.555 HD12 HD22 ' B' ' 504' ' ' LEU . 69.3 mt -69.23 166.83 17.57 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.399 0.619 . . . . 0.0 112.186 -172.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -73.57 163.95 27.32 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.406 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.43 -44.8 76.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.278 0.561 . . . . 0.0 109.842 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -64.83 -31.3 72.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.165 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.4 m -60.55 -45.73 92.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.17 0.51 . . . . 0.0 110.797 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.662 HD13 ' HZ2' ' A' ' 175' ' ' LYS . 87.4 mt -68.91 -38.56 79.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.791 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -63.05 -40.39 97.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.512 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -64.08 -41.58 97.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.272 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.524 ' HH ' HD11 ' A' ' 189' ' ' ILE . 62.6 t80 -54.02 -52.29 61.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.762 173.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.964 ' HZ2' HG23 ' A' ' 181' ' ' ILE . 22.5 mtpp -67.19 -28.13 67.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.207 -175.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -78.22 -42.57 30.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.681 0.277 . . . . 0.0 111.148 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -77.43 -36.78 52.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.687 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.494 ' CE1' HG21 ' B' ' 490' ' ' ILE . 43.7 m-85 -83.72 -4.21 58.42 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.337 178.257 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 59.03 78.77 0.25 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.625 0.578 . . . . 0.0 111.174 178.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.582 HD12 ' HG2' ' A' ' 162' ' ' LYS . 92.5 mt -115.71 113.19 42.58 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.06 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 15.9 Cg_exo -68.07 135.92 36.27 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.647 2.898 . . . . 0.0 112.057 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 3.7 t -171.04 159.73 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.652 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -67.79 156.63 88.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.543 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.32 154.59 32.15 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.723 2.282 . . . . 0.0 112.407 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 85.36 50.4 4.06 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.258 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 86.5 mt -94.03 145.38 24.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.854 0.359 . . . . 0.0 110.56 -179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.434 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 88.4 m-20 -113.59 178.03 4.42 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.256 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.687 ' O ' HG21 ' A' ' 179' ' ' VAL . 55.4 tptt -46.05 -57.91 4.05 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.879 0.737 . . . . 0.0 112.166 -177.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . 0.539 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -54.52 -49.63 69.76 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -176.069 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.1 -43.02 91.84 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.017 0.437 . . . . 0.0 110.594 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 94.8 mt -61.81 -48.85 78.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.022 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.687 HG21 ' O ' ' A' ' 175' ' ' LYS . 13.6 t -58.66 -42.6 85.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.501 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 19.3 mm-40 -58.28 -49.74 76.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.651 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.964 HG23 ' HZ2' ' A' ' 162' ' ' LYS . 79.6 mt -65.4 -48.48 82.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.068 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.561 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.1 t -59.28 -45.76 92.88 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.959 -177.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.16 -39.91 94.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.374 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.4 t -59.22 -40.49 86.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.755 0.312 . . . . 0.0 110.726 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -87.25 -26.43 23.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.776 0.322 . . . . 0.0 111.089 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.561 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 27.4 t80 -60.9 -44.02 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.008 0.523 . . . . 0.0 111.136 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.551 ' HB3' ' HZ2' ' A' ' 187' ' ' LYS . 8.1 mtpm? -79.94 21.64 0.55 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.06 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 45.5 m -145.77 28.75 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.816 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.623 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 73.2 mt -90.1 125.38 60.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.666 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.47 140.3 51.97 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.837 2.358 . . . . 0.0 110.973 172.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.495 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.0 p -153.05 134.74 5.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.16 0.505 . . . . 0.0 110.925 -174.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -102.78 109.17 20.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.587 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 40.1 tt0 -47.89 -62.56 1.4 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -169.05 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -65.37 -45.13 85.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.504 0.192 . . . . 0.0 111.494 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.68 -43.26 99.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.601 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 89.7 m -65.2 -37.16 86.44 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.039 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 22.1 mt -60.99 -47.27 87.23 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.4 m -59.17 -46.06 89.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.354 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 69.3 m -61.15 -51.22 69.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.346 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.589 ' CD1' HD23 ' B' ' 488' ' ' LEU . 45.8 t80 -56.24 -55.99 26.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.291 -178.14 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.588 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 74.9 mt -55.72 -48.86 77.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.21 -42.07 98.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.845 -177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.4 m -62.95 -42.77 99.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.414 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.428 HG22 ' O ' ' A' ' 200' ' ' PHE . 56.6 t -68.84 -28.09 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.04 0.448 . . . . 0.0 110.736 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.588 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 14.2 mmm-85 -72.92 -18.05 61.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.538 175.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -92.89 -45.22 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -164.27 168.77 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' B' ' 498' ' ' ARG . 13.3 mptt -91.42 -10.49 40.83 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.724 178.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.26 151.51 13.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 176.372 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.42 ' HA ' ' HG3' ' B' ' 494' ' ' GLU . 54.3 mtpt 51.43 46.17 26.9 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.501 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 15.6 m -52.09 109.23 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.583 0.552 . . . . 0.0 110.957 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -75.05 130.55 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.389 -175.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 32.1 tp -150.47 -43.03 0.13 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.194 -177.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -170.48 170.22 7.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.027 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -85.43 -65.12 1.05 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.879 0.371 . . . . 0.0 110.658 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -163.45 142.8 8.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.968 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 12.0 p -145.7 17.94 1.47 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.165 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 105.16 -111.46 3.74 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.829 177.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 34.8 m -105.93 -9.85 10.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.64 0.257 . . . . 0.0 111.378 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 . . . . . 0 C--O 1.243 0.712 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.622 177.284 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.636 0.255 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -97.31 148.69 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.706 0.289 . . . . 0.0 110.379 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -131.69 117.81 19.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.13 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 17.3 m -86.55 131.73 34.09 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -65.6 -38.21 88.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.31 0.576 . . . . 0.0 109.752 174.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -136.42 112.5 9.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.405 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -104.19 -126.12 5.75 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.467 176.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . 0.403 ' HB ' ' OG ' ' B' ' 465' ' ' SER . 47.9 t -84.92 -34.84 9.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.92 0.39 . . . . 0.0 109.997 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 119.63 -122.78 5.41 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.595 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 463' ' ' THR . . . . . 0.419 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.0 OUTLIER -75.04 -26.33 59.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.337 . . . . 0.0 111.707 -176.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.459 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.1 mp0 -63.33 -40.84 98.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.127 177.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 465' ' ' SER . . . . . 0.403 ' OG ' ' HB ' ' B' ' 461' ' ' VAL . 12.1 m -68.06 -29.84 68.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.229 176.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.419 ' HB3' ' O ' ' B' ' 463' ' ' THR . 54.4 tp -64.91 -46.22 82.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.745 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.8 t80 -52.59 -58.88 5.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.61 175.194 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.485 ' HE2' HD12 ' A' ' 201' ' ' ILE . 59.3 m-85 -62.62 -32.07 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.76 -45.27 90.58 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.032 0.444 . . . . 0.0 110.393 176.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -63.39 -43.44 97.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.421 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.0 t -57.63 -43.72 84.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.068 0.461 . . . . 0.0 110.444 177.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -56.74 -50.9 70.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.552 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -77.29 -24.59 50.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.607 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -78.45 -42.1 30.89 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.71 -44.94 22.36 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.998 -177.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 70.06 -55.49 0.6 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.912 0.757 . . . . 0.0 111.927 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.506 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 8.8 t -63.74 125.97 26.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.438 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.62 -46.16 84.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.312 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -31.27 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.36 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.439 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -72.86 -41.87 64.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.988 0.423 . . . . 0.0 110.942 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.54 -37.54 77.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.246 0.546 . . . . 0.0 109.748 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.672 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 28.8 tt0 -64.29 -38.57 91.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.405 175.5 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.759 HD22 HG13 ' A' ' 148' ' ' VAL . 25.4 t-20 -58.03 -44.57 87.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.873 176.531 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -55.98 -45.79 78.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.166 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.495 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.7 mt -67.79 -29.13 68.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.227 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.672 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -62.99 -43.19 99.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.918 0.389 . . . . 0.0 110.101 173.62 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.63 -35.82 78.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.266 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.589 HD23 ' CD1' ' A' ' 200' ' ' PHE . 25.0 mt -66.52 -52.08 49.72 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.265 179.376 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 11.2 m -61.06 -41.91 91.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.561 HD12 ' HE1' ' A' ' 186' ' ' PHE . 18.7 pt -69.7 -27.49 33.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.838 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -67.89 -39.1 83.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 109.841 172.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . 0.496 HD22 ' HA ' ' A' ' 200' ' ' PHE . 14.8 m120 -72.48 -35.28 68.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.261 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.06 18.65 3.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.528 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . 0.42 ' HG3' ' HA ' ' A' ' 210' ' ' LYS . 13.7 tt0 56.26 49.11 15.89 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.162 0.506 . . . . 0.0 111.463 178.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.447 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 75.7 t -103.43 -49.26 10.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.582 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.448 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 44.8 pt -112.24 172.16 3.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.917 0.389 . . . . 0.0 110.966 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 18.9 p -109.43 179.73 4.06 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.786 176.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.516 ' O ' HG21 ' B' ' 502' ' ' VAL . 57.9 ttp180 -59.85 -47.83 84.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.775 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.76 70.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.784 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.462 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.4 mm-40 -56.36 -46.03 80.2 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.158 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.413 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 63.6 tp -58.31 -48.62 79.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.43 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.538 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 67.1 t -65.65 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.16 -177.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.413 HE21 ' HB2' ' B' ' 503' ' ' GLN . 16.2 mt-30 -77.04 -30.69 55.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -176.089 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.555 HD22 HD12 ' A' ' 153' ' ' LEU . 44.3 mt -66.73 -41.62 87.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.984 0.421 . . . . 0.0 111.78 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -86.94 10.41 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.353 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.68 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 78.2 p -64.77 -44.2 72.18 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.68 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 24.1 Cg_exo -67.46 -8.53 22.45 Favored 'Trans proline' 0 C--N 1.358 1.068 0 C-N-CA 122.086 1.858 . . . . 0.0 111.977 176.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -99.92 -67.9 0.83 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.753 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.601 HD22 HD21 ' B' ' 515' ' ' LEU . 67.0 mt -96.22 -8.1 33.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.438 -173.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.68 -16.31 61.01 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 121.093 -0.575 . . . . 0.0 113.043 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.587 ' HE3' ' O ' ' B' ' 507' ' ' PRO . 0.0 OUTLIER -87.76 -2.91 58.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.932 0.396 . . . . 0.0 110.518 178.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -117.77 96.78 50.02 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.732 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.52 -52.5 8.75 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.195 2.596 . . . . 0.0 112.879 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.21 -39.82 87.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.905 0.383 . . . . 0.0 111.461 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.601 HD21 HD22 ' B' ' 509' ' ' LEU . 25.4 tp -79.8 -44.1 21.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.957 -172.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.405 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 8.7 t80 -69.02 -32.98 72.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.284 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -73.77 -35.37 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.125 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.459 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 11.5 t90 -56.38 -48.82 76.08 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 173.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.538 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 21.6 t80 -55.92 -45.93 78.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.678 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.405 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 99.0 mttt -59.71 -47.93 83.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.107 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -62.21 -41.92 98.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -177.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -64.75 -35.54 81.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.052 0.453 . . . . 0.0 110.694 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.48 -7.15 57.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.172 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 68.41 26.82 74.09 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.969 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -86.26 130.49 34.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 110.531 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -128.27 147.09 50.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.382 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -107.98 12.34 27.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 110.526 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 12.4 p . . . . . 0 C--O 1.25 1.099 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.54 -179.969 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' SER . . . . . 0.702 ' HB3' ' HA2' ' A' ' 135' ' ' GLY . 16.0 m . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 121.123 0.487 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -123.26 -30.63 3.68 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.337 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.23 171.21 7.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.754 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . 0.621 ' HA3' ' HA ' ' A' ' 134' ' ' ASP . . . -168.64 116.31 0.66 Allowed Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.737 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 56.5 m -61.94 -28.12 69.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.389 . . . . 0.0 111.348 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -131.31 -60.25 0.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -119.03 131.71 56.0 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 171.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . 0.621 ' HA ' ' HA3' ' A' ' 130' ' ' GLY . 5.4 p-10 -69.41 134.6 49.2 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.152 0.501 . . . . 0.0 111.07 -176.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 127' ' ' SER . . . 82.19 -8.32 61.23 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.121 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -144.46 38.69 1.28 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.727 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -92.49 2.33 56.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.857 0.361 . . . . 0.0 110.962 -177.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.4 m -95.05 111.37 54.47 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.221 -179.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -77.63 162.1 30.42 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.249 2.633 . . . . 0.0 111.606 176.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 58.3 t 61.57 91.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.093 0.473 . . . . 0.0 111.315 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.824 ' HG3' ' HD3' ' B' ' 476' ' ' ARG . 8.2 tt0 62.51 78.34 0.3 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.953 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -79.24 -11.62 59.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.409 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 48.9 mt -113.03 144.9 19.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' B' ' 477' ' ' SER . 18.5 t70 -104.93 -60.63 1.58 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' THR . . . . . 0.403 ' HG1' ' C ' ' A' ' 144' ' ' ASP . 97.9 m -164.28 108.63 0.89 Allowed Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.776 177.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.17 143.03 82.76 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.241 1.96 . . . . 0.0 111.748 176.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -98.66 118.99 36.62 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.148 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.0 p -81.97 123.66 38.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.304 0.574 . . . . 0.0 110.792 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -89.39 131.26 35.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.177 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.448 HD13 HG12 ' A' ' 182' ' ' VAL . 96.8 mt -111.21 6.38 20.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.242 0.544 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -81.66 -26.73 34.51 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.55 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 28.0 pt20 -67.79 -22.51 65.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.578 175.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.519 HD21 HD23 ' B' ' 504' ' ' LEU . 30.8 mt -67.26 151.14 48.04 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . 0.49 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 50.9 mt-30 -63.83 148.46 49.26 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.497 HG12 ' HE ' ' A' ' 159' ' ' ARG . 48.3 t -56.96 -46.85 84.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.199 0.523 . . . . 0.0 109.892 178.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.17 -33.42 74.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.606 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.732 HG21 ' HG2' ' B' ' 500' ' ' GLU . 25.8 m -64.42 -45.67 86.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.897 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.576 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.6 mt -64.25 -37.32 87.05 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 110.519 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.497 ' HE ' HG12 ' A' ' 155' ' ' VAL . 74.2 mtt-85 -67.68 -38.13 83.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.53 176.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.562 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.6 ttm180 -65.2 -42.88 93.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.061 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.428 ' OH ' HD11 ' A' ' 189' ' ' ILE . 58.0 t80 -53.3 -47.81 68.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.916 173.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.764 ' HZ1' ' HB ' ' A' ' 181' ' ' ILE . 43.6 mttp -61.33 -49.43 77.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.823 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -63.79 -48.1 78.24 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -65.66 -41.77 92.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.91 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -87.0 3.22 46.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.666 -178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 55.74 60.58 3.22 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.043 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 162' ' ' LYS . 85.9 mt -94.45 130.7 32.91 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.957 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.33 125.24 15.85 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.163 1.909 . . . . 0.0 111.423 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 3.2 p -150.81 -175.52 5.16 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.938 -177.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -132.3 147.05 64.16 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -59.3 131.91 43.62 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.345 2.03 . . . . 0.0 111.682 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.84 46.82 3.06 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.71 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 90.9 mt -75.46 152.02 37.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.042 0.449 . . . . 0.0 111.151 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.487 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 6.2 m-20 -104.21 164.74 11.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.529 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.431 ' HE2' HG21 ' A' ' 155' ' ' VAL . 5.8 tmtt? -56.33 -50.08 72.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.667 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.95 85.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.42 ' HA ' ' HG2' ' A' ' 180' ' ' GLU . 10.2 mm-40 -61.63 -41.71 97.87 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.555 0.693 . . . . 0.0 110.249 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.576 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 98.7 mt -61.85 -52.06 65.69 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.883 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.444 HG13 ' HB2' ' A' ' 150' ' ' LEU . 78.5 t -58.24 -48.99 83.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 O-C-N 123.614 0.571 . . . . 0.0 111.626 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.548 ' HG3' ' N ' ' A' ' 181' ' ' ILE . 6.7 pt-20 -62.02 -46.19 90.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.44 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.764 ' HB ' ' HZ1' ' A' ' 162' ' ' LYS . 80.6 mt -70.95 -39.27 74.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 120.622 0.249 . . . . 0.0 110.916 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.512 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 54.6 t -64.66 -47.55 88.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.94 -41.16 98.77 Favored Glycine 0 N--CA 1.449 -0.482 0 O-C-N 123.454 0.471 . . . . 0.0 112.432 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.7 t -59.19 -45.14 91.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.891 0.377 . . . . 0.0 110.544 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -78.27 -29.76 48.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.565 ' HE1' HD11 ' B' ' 490' ' ' ILE . 15.3 t80 -60.83 -39.02 87.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.683 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -75.78 6.6 4.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 p -128.88 21.09 5.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.922 0.392 . . . . 0.0 111.248 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.703 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.3 mt -88.85 118.35 69.2 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.417 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -78.22 137.74 15.44 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.003 2.469 . . . . 0.0 111.569 176.453 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.531 HG12 ' HB3' ' B' ' 485' ' ' LEU . 0.0 OUTLIER -124.77 167.18 19.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.21 0.528 . . . . 0.0 111.786 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -125.28 110.38 13.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.684 174.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -48.36 -59.82 3.16 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.392 0.433 . . . . 0.0 111.766 -172.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -55.55 -57.37 12.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.68 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.43 -48.37 79.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.602 -173.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.1 m -63.59 -41.14 98.38 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.541 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 68.8 mt -65.17 -43.22 92.42 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.193 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.1 m -59.26 -41.09 87.98 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.699 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 91.7 m -58.36 -55.99 27.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 176.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.519 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 60.6 t80 -57.53 -50.81 71.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.399 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.465 HD13 ' HE2' ' B' ' 468' ' ' PHE . 63.9 mt -57.36 -55.13 22.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.766 -175.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.48 -32.74 70.39 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.0 m -70.45 -45.97 64.73 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.218 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.1 -27.96 20.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.974 0.416 . . . . 0.0 111.158 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 -72.55 -8.91 57.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.188 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -106.42 -51.51 2.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.745 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -159.66 -64.72 0.07 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.842 0.353 . . . . 0.0 110.951 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.635 ' HG3' ' H ' ' A' ' 209' ' ' ASN . 7.0 ptpp? -171.6 -65.35 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.747 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . 0.635 ' H ' ' HG3' ' A' ' 208' ' ' LYS . 24.1 p30 -155.15 161.14 41.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -88.68 84.53 6.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 22.3 m -109.32 5.22 23.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.721 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -105.94 111.78 24.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.793 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 92.0 mt -114.8 167.82 10.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.651 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -74.08 134.11 42.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.998 0.428 . . . . 0.0 111.165 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -135.25 -45.85 0.7 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.475 178.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -91.76 115.76 28.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 13.7 p -156.44 138.3 14.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.443 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -130.89 75.94 0.42 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.347 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 13.8 p -93.16 -25.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.491 0.186 . . . . 0.0 110.937 -177.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 . . . . . 0 C--O 1.251 1.144 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.895 -176.645 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 22.9 p . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 120.636 0.255 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -107.34 -50.3 3.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.807 0.337 . . . . 0.0 110.591 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -144.49 158.45 43.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.908 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 38.8 m -92.11 101.89 14.42 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.068 0.461 . . . . 0.0 110.622 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -86.63 165.8 15.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.189 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -71.59 -21.84 61.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.723 0.297 . . . . 0.0 110.384 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -77.97 93.73 1.19 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.761 176.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.36 -20.76 5.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.25 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -122.67 26.54 6.22 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.231 -0.748 . . . . 0.0 111.231 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.25 -38.0 85.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.366 . . . . 0.0 111.497 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.452 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.6 mp0 -58.56 -43.77 89.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.598 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 6.8 m -59.29 -44.07 92.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.028 0.442 . . . . 0.0 110.441 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.08 -49.83 76.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.815 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.4 t80 -53.03 -55.87 20.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.6 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.519 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 29.9 m-85 -63.92 -34.25 77.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.42 -43.65 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.542 -0.463 . . . . 0.0 109.985 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.56 -45.28 93.64 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 175.786 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.513 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -57.31 -49.41 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.987 0.422 . . . . 0.0 110.383 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -62.68 -38.41 90.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.838 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 tptp -80.35 -33.01 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.521 -174.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -80.56 -46.25 16.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.319 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.1 -46.66 87.73 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.7 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . 0.824 ' HD3' ' HG3' ' A' ' 141' ' ' GLN . 51.1 mtt85 71.55 -49.24 0.68 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.74 0.65 . . . . 0.0 112.705 173.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.465 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.0 t -66.21 129.45 39.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.711 -178.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.34 70.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.727 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -75.55 -22.5 56.99 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.835 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -66.28 -51.41 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.133 0.492 . . . . 0.0 110.117 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.479 ' CE2' HD11 ' B' ' 485' ' ' LEU . 90.5 t80 -63.37 -40.64 97.8 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.945 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.553 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 38.1 tt0 -60.76 -42.78 98.11 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.865 177.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.415 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 6.9 t30 -59.38 -39.9 84.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.6 -45.95 81.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.389 0.614 . . . . 0.0 109.915 172.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.531 ' HB3' HG12 ' A' ' 191' ' ' VAL . 83.5 mt -67.02 -33.19 75.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.362 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.703 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.0 OUTLIER -57.75 -45.79 85.41 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.224 0.535 . . . . 0.0 109.867 174.132 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 36.4 m -59.69 -38.93 82.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.401 176.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . . . . . . . . . 39.9 mt -65.34 -49.31 69.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 10.8 m -63.76 -42.89 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.665 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.565 HD11 ' HE1' ' A' ' 186' ' ' PHE . 26.5 pt -69.89 -28.53 37.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.874 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -67.61 -43.05 81.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.172 0.511 . . . . 0.0 110.344 174.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -79.49 -16.21 56.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.791 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -98.64 21.26 11.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.361 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 65.84 25.74 11.23 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.404 0.44 . . . . 0.0 112.103 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.562 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 89.2 t -92.25 -56.19 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.755 0.312 . . . . 0.0 110.663 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.431 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 32.8 pt -111.04 162.48 8.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.726 0.298 . . . . 0.0 110.289 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 8.9 t -105.82 -175.24 2.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.13 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.527 ' O ' HG22 ' B' ' 502' ' ' VAL . 37.3 ttm180 -55.85 -51.65 66.77 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.677 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -50.46 -50.81 51.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.892 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.732 ' HG2' HG21 ' A' ' 157' ' ' THR . 3.8 mp0 -60.47 -45.17 94.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.939 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.616 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 64.9 tp -57.32 -46.0 83.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.029 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.773 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 54.5 t -64.54 -38.01 81.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.954 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.55 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 48.6 mt-30 -71.37 -42.48 68.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.912 -177.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.519 HD23 HD21 ' A' ' 153' ' ' LEU . 76.5 mt -63.33 -40.86 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.565 HG23 ' HG ' ' B' ' 509' ' ' LEU . 6.7 p -86.63 4.49 3.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.982 0.42 . . . . 0.0 111.262 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.446 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 24.0 t -59.0 -52.44 74.77 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.751 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' B' ' 506' ' ' SER . 10.8 Cg_endo -57.75 -18.35 33.5 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 122.082 1.854 . . . . 0.0 113.154 176.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.71 -52.0 5.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.565 ' HG ' HG23 ' B' ' 505' ' ' VAL . 62.4 mt -97.71 -11.72 23.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.536 -174.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.56 -14.04 64.14 Favored Glycine 0 C--O 1.23 -0.136 0 C-N-CA 121.391 -0.433 . . . . 0.0 112.875 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.436 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 53.1 mttm -77.22 -15.51 59.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.271 0.557 . . . . 0.0 109.659 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -124.08 96.89 41.55 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.247 -176.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -49.58 -48.3 19.56 Favored 'Trans proline' 0 CA--C 1.529 0.253 0 C-N-CA 123.234 2.622 . . . . 0.0 113.504 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -66.94 -40.6 87.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.985 0.421 . . . . 0.0 111.088 -177.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 18.5 tp -69.23 -44.84 71.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.523 -175.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -68.31 -32.88 73.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.087 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -63.5 -43.0 98.48 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.452 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 12.4 t90 -57.28 -49.06 77.26 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.846 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.773 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 66.9 t80 -59.04 -46.72 87.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.145 -178.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -64.17 -36.25 83.46 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.968 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -72.01 -37.42 69.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.108 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -66.87 -34.35 77.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.28 0.562 . . . . 0.0 110.583 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.48 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 9.0 mp -83.93 -14.65 50.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.038 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.97 35.82 61.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.139 -174.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -77.5 114.84 16.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.253 -0.473 . . . . 0.0 110.468 -177.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -100.16 147.04 26.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.967 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -107.17 75.95 1.06 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.4 0.619 . . . . 0.0 110.786 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 34.5 t . . . . . 0 C--O 1.251 1.174 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.881 177.021 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 120.667 0.27 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -82.8 160.28 22.28 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.816 0.341 . . . . 0.0 110.694 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -90.54 120.69 31.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.041 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -140.32 175.61 21.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.5 t -134.82 104.24 5.93 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -155.76 159.41 39.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.211 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -136.63 -45.02 0.6 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.071 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -74.84 157.66 34.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.368 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 164.9 149.71 5.92 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.921 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.24 24.15 76.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.292 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -92.37 148.68 21.93 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.424 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 27.3 t -76.0 112.69 21.73 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 6.8 Cg_exo -74.22 -17.59 21.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.956 2.437 . . . . 0.0 112.519 -176.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 18.3 m -126.12 164.87 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.177 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -164.81 95.77 0.71 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.165 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -102.48 -34.62 9.07 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 37.6 mt 71.8 136.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 114.631 -1.168 . . . . 0.0 111.634 178.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -93.7 -68.17 0.82 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.028 176.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.9 m -154.89 114.08 2.37 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.432 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -57.91 133.26 54.74 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.367 2.044 . . . . 0.0 111.296 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.42 110.09 6.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.302 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -73.7 110.36 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.582 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 18.9 t0 -72.38 88.15 1.18 Allowed 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.511 HD23 HD21 ' B' ' 504' ' ' LEU . 95.7 mt -89.57 -8.06 53.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.818 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -82.69 -23.06 34.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.865 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.582 ' NE2' ' HB3' ' A' ' 149' ' ' ASP . 27.5 pt20 -74.2 -18.94 60.69 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.86 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.453 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.3 mt -65.79 155.27 36.71 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.742 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -71.26 158.93 35.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.159 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 16.6 t -60.67 -46.32 96.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 109.972 -179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . 0.522 ' HA ' ' HB3' ' A' ' 159' ' ' ARG . 84.7 m-20 -67.71 -21.34 65.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.733 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.3 m -69.5 -51.32 36.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.183 0.516 . . . . 0.0 110.468 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 30.7 mt -65.96 -32.58 74.16 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 122.034 0.921 . . . . 0.0 109.57 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.522 ' HB3' ' HA ' ' A' ' 156' ' ' ASN . 77.8 ttt180 -63.08 -43.37 98.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.568 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 17.8 ttm180 -69.5 -37.73 77.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.543 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.497 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 70.9 t80 -51.53 -57.37 9.25 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.605 0.24 . . . . 0.0 110.7 174.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.664 ' HZ2' HD21 ' A' ' 178' ' ' LEU . 7.1 ptpp? -66.96 -27.02 67.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.794 0.33 . . . . 0.0 111.13 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -69.43 -47.95 62.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.777 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -71.93 -45.44 61.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.042 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.426 ' CZ ' HG23 ' B' ' 490' ' ' ILE . 70.8 m-85 -81.74 1.91 32.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.331 -177.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 57.4 74.47 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.25 176.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.651 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 90.0 mt -111.45 106.86 57.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.944 177.734 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -58.63 126.02 20.04 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.305 2.003 . . . . 0.0 111.39 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.634 ' HB ' HD11 ' A' ' 173' ' ' LEU . 3.1 p -133.35 165.36 25.01 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.125 -176.173 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -107.28 140.91 21.93 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -56.66 137.24 80.22 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.755 2.303 . . . . 0.0 112.488 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 99.9 42.47 2.64 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.337 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.634 HD11 ' HB ' ' A' ' 169' ' ' THR . 95.8 mt -85.93 145.67 27.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.95 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.618 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 18.0 m120 -102.04 169.59 8.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.999 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.515 ' O ' HG21 ' A' ' 179' ' ' VAL . 22.5 tptm -59.87 -54.24 48.5 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.317 -178.142 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.79 -33.39 72.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.982 0.42 . . . . 0.0 110.66 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.618 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 15.6 mm100 -62.0 -45.06 95.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.304 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.664 HD21 ' HZ2' ' A' ' 162' ' ' LYS . 62.7 mt -59.14 -47.49 85.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.518 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.515 HG21 ' O ' ' A' ' 175' ' ' LYS . 18.3 t -59.29 -45.05 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.072 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -61.64 -46.13 91.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.17 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 86.8 mt -58.49 -45.84 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-O 121.165 0.507 . . . . 0.0 110.426 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.548 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 70.3 t -62.22 -48.63 87.52 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.991 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -65.02 -38.89 95.97 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.384 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 48.2 t -59.03 -43.29 91.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.801 0.334 . . . . 0.0 110.811 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -84.47 -23.23 29.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 110.951 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.574 ' HE1' HD11 ' B' ' 490' ' ' ILE . 20.7 t80 -64.41 -41.62 96.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.799 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -70.62 -18.35 62.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.677 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 14.9 p -106.5 27.41 8.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.608 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.9 mt -89.9 114.07 59.4 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.547 0.213 . . . . 0.0 110.448 175.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -68.49 103.92 1.03 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.436 2.091 . . . . 0.0 111.663 177.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.584 HG22 ' HB3' ' B' ' 485' ' ' LEU . 9.9 p -110.47 156.85 11.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -127.81 126.23 41.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.4 tt0 -50.9 -59.71 3.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.92 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.91 -57.16 13.83 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.62 -39.59 84.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 -171.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 95.6 m -67.58 -38.63 84.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.611 -178.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 39.6 mt -63.41 -46.11 87.9 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 174.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.6 m -59.09 -40.55 85.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.535 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 21.1 m -57.56 -55.79 30.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.248 177.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.55 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.5 t80 -62.09 -51.58 67.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.235 -175.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.55 -48.88 85.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.78 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -71.43 -31.2 66.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.081 -174.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.5 m -72.7 -53.97 10.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.198 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.47 HG12 HD22 ' B' ' 523' ' ' LEU . 54.4 t -65.29 -36.09 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.658 -174.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -72.33 -8.17 53.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 111.079 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -101.88 -52.85 3.08 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.128 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.415 ' CG ' ' H ' ' A' ' 208' ' ' LYS . 9.4 t70 -166.6 -159.74 0.37 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.53 ' HD3' ' O ' ' B' ' 523' ' ' LEU . 25.2 mtmm -135.34 131.89 36.97 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 121.95 -0.469 . . . . 0.0 111.07 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 10.6 m120 68.42 -76.34 0.06 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.982 0.801 . . . . 0.0 110.688 -177.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 82.6 tttt 68.55 158.29 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.094 0.558 . . . . 0.0 111.422 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 16.5 t 67.29 32.85 5.72 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.731 0.776 . . . . 0.0 109.843 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -81.37 40.93 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.893 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 49.3 tp -71.91 134.82 46.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.501 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm 71.36 99.17 0.07 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.992 0.807 . . . . 0.0 110.423 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -78.48 -22.36 47.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.439 -175.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -80.85 140.01 35.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 110.424 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 19.6 m -135.62 32.44 3.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.33 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -80.2 56.55 4.63 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.663 -178.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.2 176.72 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.823 0.344 . . . . 0.0 110.89 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 . . . . . 0 C--O 1.245 0.818 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.85 -178.175 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 21.7 p . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 110.566 -0.161 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 67.32 175.63 0.25 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.21 0.604 . . . . 0.0 111.389 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -125.0 -32.11 3.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.731 0.301 . . . . 0.0 111.624 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 18.3 m -133.48 133.55 42.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.626 -178.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -76.79 145.9 38.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.613 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -122.37 -170.1 2.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.245 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 118.85 -132.08 9.48 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.673 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 39.7 t -90.92 84.44 2.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.311 0.577 . . . . 0.0 109.978 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -156.54 26.07 0.52 Allowed Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.124 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.6 t -76.86 -24.17 52.64 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -64.16 -47.91 78.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.663 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.2 m -60.77 -35.11 75.61 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.241 177.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.419 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 35.9 tp -63.08 -52.33 63.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.153 176.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.491 ' O ' HG21 ' B' ' 471' ' ' VAL . 65.8 t80 -52.54 -57.89 8.53 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.95 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -64.39 -34.53 78.38 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.4 -40.63 96.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.252 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . 0.419 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.1 mttt -68.27 -34.92 77.06 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.696 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.491 HG21 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -63.1 -42.92 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.073 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.24 92.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.441 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -74.35 -36.55 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.185 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.581 ' HB3' ' CE2' ' B' ' 512' ' ' PHE . . . -66.6 -48.95 67.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.69 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . 0.426 HD23 ' O ' ' B' ' 480' ' ' ALA . 10.3 mp -71.43 -37.15 71.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.026 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 71.89 -60.83 0.51 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 124.134 0.896 . . . . 0.0 112.642 170.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 45.4 m -67.51 139.45 56.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.945 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -58.03 -44.72 87.51 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.06 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -65.12 -39.11 92.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.557 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.426 ' O ' HD23 ' B' ' 475' ' ' LEU . . . -62.09 -51.57 67.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.871 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -65.84 -36.94 84.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.215 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.667 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 30.3 tt0 -59.44 -42.13 91.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 175.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.645 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.1 t30 -60.8 -43.29 98.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.98 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.8 -45.19 70.7 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.325 0.583 . . . . 0.0 110.359 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.584 ' HB3' HG22 ' A' ' 191' ' ' VAL . 86.2 mt -67.53 -31.81 72.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.466 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.667 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -63.39 -36.91 85.28 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.218 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.1 m -65.14 -36.2 83.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.897 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.55 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.3 mt -65.25 -48.55 72.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.337 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.4 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 13.9 m -65.04 -42.26 94.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.828 -177.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.574 HD11 ' HE1' ' A' ' 186' ' ' PHE . 38.7 pt -69.15 -30.74 47.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.169 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -68.37 -45.01 73.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.111 0.481 . . . . 0.0 110.242 173.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -62.24 -38.8 90.61 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.991 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 89.7 mt-30 -86.31 16.28 4.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.698 -176.137 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . 0.409 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 0.1 OUTLIER 63.08 38.95 10.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.985 0.421 . . . . 0.0 111.045 174.926 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.568 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.9 t -96.7 -33.71 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.255 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 39.0 pt -124.73 153.32 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.929 0.395 . . . . 0.0 111.212 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 46.2 m -80.02 166.23 21.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.019 178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.498 ' O ' HG22 ' B' ' 502' ' ' VAL . 20.7 ttm180 -54.92 -53.98 48.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.765 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.56 85.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.823 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.543 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.0 mm-40 -55.48 -46.29 76.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.67 -51.12 71.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.038 0.447 . . . . 0.0 110.99 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.498 HG22 ' O ' ' B' ' 498' ' ' ARG . 59.9 t -60.09 -35.44 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.667 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -67.42 -42.25 83.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.91 178.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.543 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 93.8 mt -66.77 -39.91 88.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 111.508 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.419 HG13 ' CE2' ' B' ' 519' ' ' PHE . 4.6 p -85.14 2.43 4.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.035 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.698 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 14.2 t -58.49 -53.84 62.1 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.357 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.698 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 31.8 Cg_exo -61.83 -26.66 79.57 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.744 1.629 . . . . 0.0 112.143 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -73.93 -60.59 2.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.575 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.605 HD22 HD22 ' B' ' 515' ' ' LEU . 78.8 mt -102.28 -10.39 19.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -172.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.21 -21.76 64.43 Favored Glycine 0 C--O 1.229 -0.166 0 C-N-CA 121.229 -0.51 . . . . 0.0 113.312 -176.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -81.98 0.95 37.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.079 0.466 . . . . 0.0 110.79 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.581 ' CE2' ' HB3' ' B' ' 474' ' ' ALA . 50.2 m-85 -125.58 90.29 50.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 174.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 -45.7 27.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.484 2.79 . . . . 0.0 113.602 -174.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.29 -45.23 73.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.975 0.417 . . . . 0.0 110.659 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.605 HD22 HD22 ' B' ' 509' ' ' LEU . 15.5 tp -67.89 -43.13 80.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.635 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.452 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 25.8 t80 -67.29 -38.84 85.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.446 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.69 -37.78 85.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.491 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.61 -49.3 75.35 Favored 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.419 ' CE2' HG13 ' B' ' 505' ' ' VAL . 66.0 t80 -58.86 -45.9 89.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.859 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.418 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 58.3 mtpt -62.95 -42.71 99.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.874 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . 0.402 HD21 ' C ' ' B' ' 521' ' ' ASN . 0.2 OUTLIER -66.44 -35.5 80.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.988 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.21 -42.72 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.346 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.53 ' O ' ' HD3' ' A' ' 208' ' ' LYS . 81.8 mt -78.21 -14.96 59.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.374 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 78.15 15.98 80.33 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.345 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -85.69 104.99 15.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -92.64 105.96 18.02 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.655 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -142.32 68.24 1.32 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.08 -175.052 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -59.6 -55.95 28.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.965 0.412 . . . . 0.0 110.941 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -140.42 -163.58 1.55 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.285 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -62.24 -33.13 85.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.171 -0.538 . . . . 0.0 111.894 177.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -67.87 103.61 1.5 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -67.14 160.46 26.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.538 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -77.66 -4.22 44.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.083 -174.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 16.5 t70 60.11 86.07 0.1 Allowed 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.773 0.671 . . . . 0.0 110.646 -177.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -165.31 101.42 0.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.884 -178.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -124.23 26.95 5.69 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 121.084 -0.579 . . . . 0.0 111.862 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -81.02 -47.0 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.17 0.509 . . . . 0.0 110.376 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.1 p -160.77 141.79 8.78 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.749 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.9 173.91 13.69 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.426 2.084 . . . . 0.0 111.959 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 16.0 m -93.7 35.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.242 -176.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 54.4 68.19 0.9 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.507 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -81.59 -3.19 52.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.982 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.413 HG21 ' HG3' ' A' ' 146' ' ' PRO . 16.7 mt -73.52 137.56 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.479 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.401 ' C ' ' HG1' ' A' ' 145' ' ' THR . 12.1 m-20 -98.36 -57.9 2.09 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.433 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' THR . . . . . 0.401 ' HG1' ' C ' ' A' ' 144' ' ' ASP . 53.3 m -163.3 113.08 1.02 Allowed Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.459 177.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.413 ' HG3' HG21 ' A' ' 143' ' ' ILE . 3.5 Cg_exo -73.72 155.63 49.17 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.534 2.156 . . . . 0.0 111.159 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -123.02 145.93 48.09 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.772 0.32 . . . . 0.0 111.256 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.87 125.23 51.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.91 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.426 ' HB2' ' OE1' ' A' ' 152' ' ' GLN . 11.0 m-20 -72.96 -30.49 63.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.687 -174.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.404 HD23 HD23 ' B' ' 504' ' ' LEU . 64.8 mt 60.5 7.16 1.26 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.114 -176.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -75.14 -26.42 59.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.436 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.6 OUTLIER -61.59 -17.87 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.076 -177.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.595 ' O ' ' HB ' ' A' ' 157' ' ' THR . 28.1 mt -80.42 4.6 17.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . 0.628 HE21 ' HA ' ' A' ' 154' ' ' GLN . 0.0 OUTLIER 55.61 -170.79 0.07 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.782 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.589 HG11 HD11 ' A' ' 178' ' ' LEU . 1.6 m -77.85 -37.64 23.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 121.632 -0.667 . . . . 0.0 110.776 172.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -58.21 -53.69 55.43 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.595 ' HB ' ' O ' ' A' ' 153' ' ' LEU . 41.9 m -70.57 -34.68 72.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.641 0.258 . . . . 0.0 111.388 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.44 HD23 HD12 ' A' ' 153' ' ' LEU . 82.8 mt -63.06 -40.18 96.92 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.351 0.596 . . . . 0.0 110.523 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.2 mtt180 -69.88 -31.4 69.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.815 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 29.4 ttm180 -68.27 -42.37 79.65 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.497 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 52.8 t80 -52.05 -51.25 58.72 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 173.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.457 ' HZ3' ' HB ' ' A' ' 181' ' ' ILE . 54.4 mttp -61.01 -43.65 98.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.745 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -70.38 -38.87 74.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.29 -175.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -79.53 -35.52 39.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -176.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.423 ' CZ ' HG23 ' B' ' 490' ' ' ILE . 59.3 m-85 -92.75 1.69 57.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 59.34 79.89 0.21 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.804 0.69 . . . . 0.0 111.38 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 96.8 mt -120.17 100.37 47.93 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.92 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -61.59 125.65 17.23 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.382 2.055 . . . . 0.0 111.657 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -130.69 137.85 49.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.883 -175.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . 0.527 ' H ' ' HD2' ' A' ' 170' ' ' ARG . 0.1 OUTLIER -66.22 146.04 99.01 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.509 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 27.9 Cg_exo -62.53 126.82 19.21 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.614 2.209 . . . . 0.0 112.104 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 114.05 51.99 0.47 Allowed Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.594 -178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 96.4 mt -89.1 164.94 14.81 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.073 0.463 . . . . 0.0 111.216 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.563 ' HB3' ' HG2' ' A' ' 177' ' ' GLN . 56.5 t30 -142.0 165.5 27.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.257 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.585 ' HE2' ' HA ' ' A' ' 154' ' ' GLN . 27.2 tptp -50.22 -54.85 18.14 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 122.84 0.456 . . . . 0.0 111.546 -178.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.49 93.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.332 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.563 ' HG2' ' HB3' ' A' ' 174' ' ' ASN . 8.6 mm100 -64.42 -38.56 91.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.54 0.686 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.589 HD11 HG11 ' A' ' 155' ' ' VAL . 96.6 mt -61.9 -44.86 95.93 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.929 176.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.27 -50.34 80.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 O-C-N 123.58 0.55 . . . . 0.0 111.36 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -56.41 -53.71 54.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.619 0.247 . . . . 0.0 111.476 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.457 ' HB ' ' HZ3' ' A' ' 162' ' ' LYS . 64.1 mt -62.63 -40.71 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-O 120.714 0.292 . . . . 0.0 111.036 -178.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.435 HG21 ' NZ ' ' A' ' 162' ' ' LYS . 39.2 t -64.64 -47.82 87.32 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.22 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.32 -36.28 92.84 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.349 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.2 t -58.63 -47.4 84.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.317 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -80.13 -28.44 38.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.497 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 59.5 t80 -61.0 -47.68 85.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.137 -177.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.627 ' HB3' ' HZ2' ' A' ' 187' ' ' LYS . 7.6 mtpm? -74.53 -3.66 32.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 -178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -106.94 17.29 23.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.991 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.657 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.4 mt -87.98 117.74 68.82 Favored Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.881 178.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -74.64 100.07 1.29 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.863 2.375 . . . . 0.0 111.0 175.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.425 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 13.3 p -115.46 135.2 56.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.061 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -108.05 125.72 51.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.027 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.0 tt0 -50.97 -59.71 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 123.63 0.581 . . . . 0.0 112.39 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -51.8 -58.21 7.09 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.656 0.614 . . . . 0.0 112.656 -173.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.02 -41.5 97.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.084 -176.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 54.7 m -65.92 -42.85 89.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 201' ' ' ILE . 53.1 mt -59.46 -43.84 93.11 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 41.8 m -59.5 -48.41 81.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.771 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.96 -49.15 78.94 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.788 0.328 . . . . 0.0 110.626 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.659 ' CD1' HD21 ' B' ' 488' ' ' LEU . 46.2 t80 -59.35 -60.39 3.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.699 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 197' ' ' LEU . 46.9 mt -58.11 -44.7 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.002 0.43 . . . . 0.0 110.497 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -61.87 -41.21 97.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.966 -178.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -63.56 -51.67 64.39 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.801 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.549 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.3 t -65.69 -28.8 45.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.226 -175.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -84.62 -1.21 55.67 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -116.77 -46.46 2.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.427 173.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.768 ' HB3' ' HB3' ' A' ' 210' ' ' LYS . 15.8 t70 -172.78 137.34 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -77.27 91.33 3.78 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.495 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 64.3 t30 62.72 78.68 0.28 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.785 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.768 ' HB3' ' HB3' ' A' ' 207' ' ' ASP . 14.5 ptmm? -82.92 139.95 33.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.37 -175.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 26.7 m -78.36 160.97 27.51 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.839 174.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -82.12 122.3 27.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.588 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 80.3 mt -116.56 97.88 6.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.633 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . 0.4 ' HB3' ' OD2' ' A' ' 216' ' ' ASP . 65.3 mttp -78.47 -55.94 4.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.56 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 62.43 20.62 12.02 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.539 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . 0.4 ' OD2' ' HB3' ' A' ' 214' ' ' LYS . 40.3 m-20 -76.02 -33.82 59.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.245 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 34.8 p 47.16 76.16 0.11 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.208 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -98.88 -72.98 1.07 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.731 -0.947 . . . . 0.0 110.731 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 32.7 t 58.55 88.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.427 0.632 . . . . 0.0 111.784 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.709 -0.662 . . . . 0.0 109.581 176.845 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 120.692 0.282 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -93.15 101.67 13.96 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -85.15 117.49 24.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 48.2 t -103.21 -44.85 5.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.108 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -162.99 -48.84 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.413 -176.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -59.67 108.93 0.81 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.802 -178.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 137.74 -33.31 2.28 Favored Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.747 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.81 128.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.007 0.432 . . . . 0.0 111.013 -178.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 144.36 30.83 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.444 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.8 p -70.09 -22.78 63.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.062 0.458 . . . . 0.0 110.975 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.16 -42.84 91.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.791 176.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 5.8 t -64.15 -35.74 81.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.284 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.36 -44.44 96.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.099 177.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.537 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.3 t80 -53.24 -55.02 27.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.463 ' HE2' HD12 ' A' ' 201' ' ' ILE . 63.5 m-85 -65.49 -32.35 73.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.13 -40.51 97.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.531 . . . . 0.0 110.253 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -68.19 -44.12 76.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.537 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.537 HG23 ' O ' ' B' ' 467' ' ' PHE . 59.8 t -55.12 -43.64 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.188 0.518 . . . . 0.0 110.052 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 28.9 mtt-85 -57.09 -53.0 63.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.799 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -73.28 -33.63 65.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.729 -174.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.565 ' HB3' ' CE2' ' B' ' 512' ' ' PHE . . . -73.62 -47.93 36.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.773 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . 0.429 ' C ' ' H ' ' B' ' 477' ' ' SER . 9.8 mp -69.26 -34.45 74.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.791 -178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 71.65 -40.54 0.48 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.937 0.773 . . . . 0.0 112.298 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.429 ' H ' ' C ' ' B' ' 475' ' ' LEU . 22.8 t -83.97 127.98 34.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.829 0.347 . . . . 0.0 110.387 -175.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.93 -46.51 84.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.664 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.21 -24.91 61.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.07 -176.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.86 -42.02 81.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.129 0.49 . . . . 0.0 109.826 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -66.69 -35.58 80.48 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 41.6 tt0 -62.52 -43.07 99.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.231 175.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.3 -45.87 72.66 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.628 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.548 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 82.3 t80 -54.98 -49.05 72.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.3 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.41 HD11 ' HA ' ' A' ' 193' ' ' GLU . 89.1 mt -63.94 -34.47 78.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.548 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.657 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.5 mtt180 -67.66 -36.8 81.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.101 0.477 . . . . 0.0 110.349 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.53 -34.03 76.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.707 174.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.659 HD21 ' CD1' ' A' ' 200' ' ' PHE . 50.5 mt -68.04 -44.2 76.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.412 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.433 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.8 m -66.72 -42.87 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.401 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.423 HG23 ' CZ ' ' A' ' 165' ' ' PHE . 19.3 pt -69.66 -26.79 31.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.752 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -67.88 -39.33 83.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.102 0.477 . . . . 0.0 110.149 173.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -71.69 -26.12 62.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.965 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -93.6 18.07 10.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 64.78 14.58 9.25 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.562 0.538 . . . . 0.0 111.762 176.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.533 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 62.0 t -76.37 -41.5 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.852 0.358 . . . . 0.0 110.355 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.437 HG23 ' CG2' ' A' ' 157' ' ' THR . 37.1 pt -122.39 169.63 13.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.975 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 9.0 t -121.01 -176.0 3.17 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.592 ' HG3' ' HB3' ' B' ' 523' ' ' LEU . 22.9 ttm180 -57.53 -48.13 80.13 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.164 0.29 . . . . 0.0 111.639 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . 0.426 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -56.79 -54.55 45.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.742 -174.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 1.7 pm0 -69.69 -32.49 71.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.522 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 61.5 tp -58.32 -49.71 76.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.798 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 99.3 t -64.07 -39.81 86.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.676 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.436 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 98.4 mt-30 -71.3 -24.96 62.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.093 -178.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 79.7 mt -70.46 -40.46 73.7 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.154 -0.341 . . . . 0.0 111.233 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.504 HG21 ' HG ' ' B' ' 509' ' ' LEU . 6.5 p -91.16 5.33 5.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 110.552 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.555 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 9.5 t -58.41 -48.64 96.59 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.345 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.7 Cg_exo -61.93 -9.3 13.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 122.353 2.036 . . . . 0.0 112.998 176.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -107.25 -60.03 1.74 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.252 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.504 ' HG ' HG21 ' B' ' 505' ' ' VAL . 82.6 mt -90.25 -12.75 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.943 -175.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -68.03 -7.07 48.82 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.706 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 52.1 mttm -84.92 -17.35 38.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.236 0.541 . . . . 0.0 109.739 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.565 ' CE2' ' HB3' ' B' ' 474' ' ' ALA . 51.2 m-85 -122.48 97.93 44.23 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.136 -175.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.6 -52.18 9.46 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 123.437 2.758 . . . . 0.0 113.596 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -66.85 -30.78 71.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 111.3 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 29.6 tp -78.09 -43.78 28.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.189 0.519 . . . . 0.0 109.988 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.442 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 9.2 t80 -67.8 -31.86 72.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.719 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -66.86 -42.92 84.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.794 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -54.18 -49.79 68.51 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.798 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 73.5 t80 -58.78 -59.48 5.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.87 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -57.0 -40.21 76.17 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -176.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -62.84 -37.7 87.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.937 0.399 . . . . 0.0 110.653 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -67.83 -47.23 69.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.902 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.592 ' HB3' ' HG3' ' B' ' 498' ' ' ARG . 3.8 mm? -70.57 -17.4 62.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.887 -177.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.91 32.59 12.44 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.382 -175.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -101.28 95.32 6.44 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 66.5 tttp -68.73 -18.69 64.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.481 -174.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 65.69 59.52 0.75 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 29.4 m . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.41 -178.273 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -88.1 -24.41 23.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.653 0.264 . . . . 0.0 111.276 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -124.38 120.65 32.73 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.529 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -120.84 152.97 16.72 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -141.28 88.5 2.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 110.278 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.66 124.13 24.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -100.6 139.27 36.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.91 0.386 . . . . 0.0 111.017 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -130.07 22.35 5.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.939 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.73 97.88 2.52 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.891 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.17 144.39 46.15 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.413 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -99.2 18.55 17.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.779 0.323 . . . . 0.0 110.759 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 32.8 t -54.12 131.79 59.83 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.869 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.45 127.61 26.94 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.92 2.414 . . . . 0.0 112.005 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 61.5 t 60.52 88.26 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.506 -173.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -89.72 94.97 10.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -95.49 -19.13 20.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.707 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 42.2 mt 70.99 144.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.551 177.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -88.8 -65.27 1.03 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 98.9 m -160.5 112.88 1.36 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.52 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.462 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 26.7 Cg_exo -62.32 136.49 60.0 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.444 2.096 . . . . 0.0 111.285 177.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -95.86 133.67 39.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.245 0.545 . . . . 0.0 111.856 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 p -92.75 102.97 14.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.457 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.61 117.93 13.79 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.54 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.45 1.9 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.13 0.49 . . . . 0.0 110.764 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -80.37 -26.99 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.729 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.609 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 6.1 pt20 -67.45 -20.91 65.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.153 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.563 HD12 HD21 ' B' ' 504' ' ' LEU . 73.0 mt -72.11 165.81 23.58 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.368 0.604 . . . . 0.0 112.182 -174.214 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . 0.546 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 23.0 mt-30 -72.2 154.15 41.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.552 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.1 t -63.12 -46.01 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.029 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -61.48 -33.15 73.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.631 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 48.2 m -61.93 -50.92 70.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.012 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.3 -39.4 93.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.126 0.489 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -67.96 -30.39 69.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.765 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.553 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.9 ttm180 -70.4 -40.86 73.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.582 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 61.6 t80 -57.03 -52.25 66.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.27 173.576 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.889 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 9.2 mtpm? -59.63 -33.62 71.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.992 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -78.19 -42.96 29.89 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.769 0.319 . . . . 0.0 111.232 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -67.07 -42.42 84.74 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -178.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -92.47 -1.38 57.02 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm 58.2 79.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.504 0.503 . . . . 0.0 111.597 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.703 HD22 HG22 ' A' ' 181' ' ' ILE . 11.0 mp -103.27 120.02 53.33 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.76 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . 0.499 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 12.9 Cg_exo -68.97 129.71 18.94 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 123.572 2.848 . . . . 0.0 112.464 -175.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.547 ' CG2' ' HZ2' ' A' ' 162' ' ' LYS . 8.9 t -178.48 169.57 1.75 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.925 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -82.6 147.3 55.36 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.375 178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_exo -69.36 132.65 24.43 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.684 2.256 . . . . 0.0 112.195 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.35 55.42 0.91 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.58 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.46 HD13 HG22 ' A' ' 169' ' ' THR . 81.9 mt -95.03 148.25 22.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.622 0.248 . . . . 0.0 110.644 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.443 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 31.5 m-80 -85.43 177.9 7.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.612 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.618 ' O ' HG22 ' A' ' 179' ' ' VAL . 22.9 tptm -57.8 -52.59 64.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.388 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.8 -40.26 79.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 111.159 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -59.56 -48.02 83.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.332 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 91.2 mt -60.49 -48.71 80.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.138 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.618 HG22 ' O ' ' A' ' 175' ' ' LYS . 23.2 t -58.8 -46.68 90.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.302 -175.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.29 -39.32 82.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 -177.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.703 HG22 HD22 ' A' ' 167' ' ' LEU . 70.7 mt -67.78 -47.34 80.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 120.805 0.336 . . . . 0.0 110.748 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.62 -47.29 85.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.78 -36.07 92.2 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.563 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 25.0 t -62.58 -39.54 94.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.853 0.359 . . . . 0.0 110.683 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -85.86 -31.75 22.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.765 0.317 . . . . 0.0 110.995 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.582 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 69.1 t80 -63.54 -40.54 97.3 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.843 0.457 . . . . 0.0 112.131 -175.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -74.41 -6.55 48.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 111.55 -177.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 62.8 m -111.89 23.38 13.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.866 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 76.0 mt -84.17 116.04 63.01 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.672 0.272 . . . . 0.0 110.953 177.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 6.2 Cg_exo -74.41 105.59 2.08 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.073 2.516 . . . . 0.0 110.751 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.421 HG23 ' HB3' ' B' ' 485' ' ' LEU . 9.8 p -108.65 143.43 18.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.895 0.378 . . . . 0.0 111.368 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -110.78 113.24 25.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.943 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.531 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 47.7 tt0 -46.01 -60.28 2.36 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -60.17 -53.68 54.8 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -63.96 -39.51 94.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.884 0.373 . . . . 0.0 110.834 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 75.4 m -64.74 -43.73 92.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 -178.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 63.6 mt -60.82 -45.06 95.9 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -56.91 -47.0 81.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.675 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 83.2 m -61.09 -50.78 71.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.417 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.581 ' CD1' HD21 ' B' ' 488' ' ' LEU . 87.1 t80 -60.93 -49.71 76.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.081 -177.485 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.455 HD11 ' HE2' ' B' ' 468' ' ' PHE . 83.9 mt -57.71 -49.95 79.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.382 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -63.27 -33.11 74.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.419 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 42.4 m -69.2 -53.21 21.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.709 0.29 . . . . 0.0 110.715 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 200' ' ' PHE . 15.2 t -66.72 -25.42 34.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.787 0.327 . . . . 0.0 110.987 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 205' ' ' ARG . 18.5 mtp180 -87.4 1.01 54.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.567 176.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -138.62 -82.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.515 0.198 . . . . 0.0 111.137 178.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -119.66 109.03 15.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.64 -56.51 20.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.448 . . . . 0.0 110.941 -177.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -161.82 29.46 0.12 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.429 0.633 . . . . 0.0 109.875 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.401 ' C ' ' HD2' ' A' ' 210' ' ' LYS . 0.0 OUTLIER -135.26 -178.53 5.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.081 -176.097 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 5.2 p -151.92 100.38 2.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.115 0.483 . . . . 0.0 111.071 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -129.59 2.17 5.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.276 178.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -89.62 97.21 11.07 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.127 0.489 . . . . 0.0 110.291 178.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . 0.513 ' HA ' ' HE3' ' A' ' 214' ' ' LYS . 0.1 OUTLIER -110.08 102.27 11.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.778 179.46 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -88.64 163.12 15.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.494 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.22 -175.8 5.16 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.104 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 50.3 m -147.04 105.24 3.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.94 0.4 . . . . 0.0 110.295 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -98.39 159.95 20.53 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.981 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 11.2 p -83.02 -30.64 8.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.057 0.456 . . . . 0.0 110.267 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.682 -178.915 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 21.6 t . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.068 0.461 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -88.18 115.26 25.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.325 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -120.81 -32.87 3.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.38 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 47.8 m 57.29 52.27 9.02 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.142 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -126.91 171.17 11.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.659 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.7 p80 -137.6 160.75 38.31 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 130.89 -84.92 0.3 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.977 176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 35.8 m -118.12 162.37 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 120.601 0.239 . . . . 0.0 110.605 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -177.32 -54.5 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.852 177.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 463' ' ' THR . . . . . 0.461 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 2.8 p -63.92 -35.79 81.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.463 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -68.28 -42.82 78.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.221 177.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -64.39 -35.53 81.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.022 0.439 . . . . 0.0 110.071 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' B' ' 463' ' ' THR . 18.8 tp -55.13 -53.51 55.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.915 174.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.527 ' CE1' ' HG ' ' B' ' 515' ' ' LEU . 79.4 t80 -54.15 -52.24 61.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.049 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.455 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.1 m-85 -64.79 -34.99 79.66 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.95 -43.12 93.77 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.33 0.586 . . . . 0.0 109.9 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.97 -45.6 94.11 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.146 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.485 HG21 ' O ' ' B' ' 467' ' ' PHE . 94.0 t -58.89 -40.57 80.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.533 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -54.07 -48.28 70.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.262 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . 0.508 ' O ' ' HG3' ' B' ' 476' ' ' ARG . 81.8 tttt -82.94 -35.02 26.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -178.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -66.71 -49.2 66.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.6 mp -67.47 -34.05 76.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.481 -178.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . 0.508 ' HG3' ' O ' ' B' ' 473' ' ' LYS . 38.4 mtm180 69.0 -58.1 0.5 Allowed 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.968 0.792 . . . . 0.0 112.377 176.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.0 t -67.54 129.96 41.55 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.849 0.357 . . . . 0.0 110.191 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.22 71.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.496 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.47 -36.62 74.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.111 0.482 . . . . 0.0 109.871 176.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.462 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.41 -45.73 78.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.4 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.402 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 70.5 t80 -65.29 -39.5 92.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.105 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 36.8 tt0 -59.25 -42.68 91.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.243 175.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.62 -43.05 99.57 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -56.4 -45.88 80.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 174.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.421 ' HB3' HG23 ' A' ' 191' ' ' VAL . 93.1 mt -66.12 -33.37 75.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.927 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.866 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 10.7 mtt85 -66.52 -36.7 83.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.052 0.453 . . . . 0.0 110.178 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.2 m -61.21 -37.24 82.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.119 0.485 . . . . 0.0 109.776 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.581 HD21 ' CD1' ' A' ' 200' ' ' PHE . 38.6 mt -64.92 -46.99 79.36 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.473 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.441 HG22 ' HA ' ' B' ' 486' ' ' ARG . 17.1 m -64.18 -41.26 91.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.562 -178.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 30.0 pt -69.42 -34.92 64.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.209 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . 0.629 ' HB2' HD22 ' B' ' 501' ' ' LEU . 90.0 t80 -61.65 -47.08 87.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.157 0.503 . . . . 0.0 109.846 172.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -61.38 -35.11 76.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.547 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -87.59 13.98 9.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.512 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.87 24.12 14.37 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 111.121 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 78.4 t -76.43 -39.11 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.644 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.596 HD12 HD23 ' B' ' 501' ' ' LEU . 30.9 pt -132.26 158.94 43.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.205 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 3.6 p -94.69 -178.3 4.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.814 0.34 . . . . 0.0 111.792 -176.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.475 ' O ' HG22 ' B' ' 502' ' ' VAL . 41.4 ttp180 -55.67 -55.09 36.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.735 -175.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . 0.505 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -58.67 -39.93 82.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.5 -176.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.61 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.805 0.336 . . . . 0.0 110.385 -178.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.649 HD11 ' CZ ' ' B' ' 519' ' ' PHE . 0.2 OUTLIER -59.09 -50.58 73.52 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.542 0.687 . . . . 0.0 109.747 177.877 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.475 HG22 ' O ' ' B' ' 498' ' ' ARG . 58.0 t -60.64 -35.19 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.704 -1.135 . . . . 0.0 111.097 -177.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.609 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 75.9 mt-30 -79.15 -35.8 41.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.675 -178.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.563 HD21 HD12 ' A' ' 153' ' ' LEU . 67.3 mt -68.19 -38.62 82.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.876 0.37 . . . . 0.0 111.44 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.533 HG21 ' HG ' ' B' ' 509' ' ' LEU . 5.6 p -86.26 1.43 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.126 0.489 . . . . 0.0 110.877 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.556 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.2 t -60.54 -47.74 95.38 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.813 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.564 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 32.4 Cg_exo -62.24 -7.08 9.37 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.285 1.99 . . . . 0.0 112.715 175.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -104.15 -58.25 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.833 0.349 . . . . 0.0 110.766 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.533 ' HG ' HG21 ' B' ' 505' ' ' VAL . 80.9 mt -88.49 -2.06 58.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.497 -174.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -65.83 -18.05 65.88 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.08 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.564 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 2.5 mptp? -92.21 -2.94 56.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.252 0.549 . . . . 0.0 109.645 178.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -127.55 85.25 61.28 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.853 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.16 -44.51 45.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.174 2.583 . . . . 0.0 112.927 -175.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.63 -46.27 89.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.024 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.527 ' HG ' ' CE1' ' B' ' 467' ' ' PHE . 2.2 tp -69.86 -40.73 75.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.736 -175.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.439 ' CE2' ' HD2' ' B' ' 520' ' ' LYS . 49.6 t80 -66.4 -41.76 88.86 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.2 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.23 -45.06 93.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.41 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.463 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 36.7 t90 -56.65 -48.6 77.21 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.145 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.649 ' CZ ' HD11 ' B' ' 501' ' ' LEU . 8.8 t80 -58.43 -47.29 84.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.856 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.439 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 50.6 mtpt -61.11 -42.49 98.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.758 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -65.56 -43.84 88.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.257 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.35 -45.51 83.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.89 0.376 . . . . 0.0 110.548 -178.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 89.4 mt -71.15 -26.91 63.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.608 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.78 36.6 8.42 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.668 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -90.84 115.98 28.32 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -133.96 17.69 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -84.78 22.08 1.42 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.874 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.488 -178.616 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -74.79 -41.6 59.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -125.23 -73.34 0.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 62.28 -148.19 48.81 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.101 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 8.2 t -79.5 123.15 27.29 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -149.75 -70.94 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.158 -177.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -173.42 175.01 3.15 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 17.8 t70 69.22 110.71 0.05 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.439 0.638 . . . . 0.0 111.769 178.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . 0.731 ' HA3' ' HA ' ' A' ' 139' ' ' PRO . . . -132.86 162.52 24.19 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.682 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -83.47 107.05 2.88 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.688 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 14.0 t70 70.59 -65.67 0.32 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.369 0.668 . . . . 0.0 110.878 -175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.0 m -109.98 103.74 54.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.992 178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.731 ' HA ' ' HA3' ' A' ' 135' ' ' GLY . 37.7 Cg_endo -67.56 -38.64 13.92 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.584 2.19 . . . . 0.0 112.051 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 46.3 t -77.47 117.69 22.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.166 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -86.91 149.22 24.96 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.987 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.1 t70 68.51 104.11 0.05 Allowed 'General case' 0 N--CA 1.465 0.308 0 O-C-N 123.932 0.77 . . . . 0.0 110.241 -175.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 1.2 pp -82.44 139.33 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.484 0.659 . . . . 0.0 112.545 -173.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.514 ' O ' ' HB2' ' B' ' 477' ' ' SER . 8.4 t70 -89.8 -54.98 3.81 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.366 167.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 39.3 m -157.81 106.88 1.78 Allowed Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.403 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -70.19 162.34 42.66 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.392 2.061 . . . . 0.0 111.045 176.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -114.67 146.58 40.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.028 0.442 . . . . 0.0 111.422 -175.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.65 124.48 62.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.71 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -88.6 135.37 33.53 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.214 175.291 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.505 HD11 HG11 ' A' ' 182' ' ' VAL . 94.5 mt -114.71 0.63 13.93 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.46 ' HA ' HG23 ' A' ' 179' ' ' VAL . 31.1 t80 -75.78 -25.41 56.41 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -66.67 -24.71 66.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.742 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.521 HD21 HD21 ' B' ' 504' ' ' LEU . 26.0 mt -62.48 147.95 47.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.852 0.358 . . . . 0.0 110.668 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -62.52 145.33 54.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.56 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.613 HG22 HD12 ' A' ' 178' ' ' LEU . 5.6 p -57.32 -35.58 49.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.588 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -73.26 -33.82 65.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.898 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 34.6 m -65.02 -40.0 94.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.161 0.505 . . . . 0.0 110.07 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.507 ' O ' ' HG2' ' A' ' 162' ' ' LYS . 29.2 mt -65.71 -38.95 90.63 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.487 0.66 . . . . 0.0 110.02 175.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -62.68 -39.39 93.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.225 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 6.6 ttm180 -68.03 -44.32 76.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.929 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.623 ' HA ' HG13 ' B' ' 495' ' ' VAL . 65.8 t80 -51.77 -57.9 7.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.871 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 158' ' ' LEU . 2.6 ptpp? -68.95 -32.4 71.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.2 -36.65 66.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.967 0.413 . . . . 0.0 110.682 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -76.74 -31.37 57.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.702 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -92.97 -4.46 52.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.767 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 60.71 60.31 1.94 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.154 0.502 . . . . 0.0 111.18 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 89.5 mt -91.53 136.22 26.98 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.061 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -61.83 125.4 16.5 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.485 2.123 . . . . 0.0 111.861 -178.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.477 ' HB ' HD11 ' A' ' 173' ' ' LEU . 19.5 p -134.0 164.7 26.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.261 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -126.92 144.72 51.25 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.377 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.38 130.84 37.63 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.772 2.315 . . . . 0.0 112.525 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 106.61 36.66 2.57 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.992 -0.623 . . . . 0.0 111.561 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.477 HD11 ' HB ' ' A' ' 169' ' ' THR . 87.2 mt -73.62 167.94 20.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.275 0.559 . . . . 0.0 111.764 -178.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.59 ' HB3' ' HG3' ' A' ' 177' ' ' GLN . 26.2 t-20 -137.82 157.93 45.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.412 -178.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.439 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.6 tptm -46.57 -52.75 12.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 122.704 0.402 . . . . 0.0 111.07 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.74 -42.23 98.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.59 ' HG3' ' HB3' ' A' ' 174' ' ' ASN . 21.5 mt-30 -63.09 -38.01 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.231 0.539 . . . . 0.0 110.345 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.613 HD12 HG22 ' A' ' 155' ' ' VAL . 89.0 mt -64.13 -41.64 97.14 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.113 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.46 HG23 ' HA ' ' A' ' 151' ' ' TYR . 80.8 t -62.49 -41.25 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 O-C-N 123.782 0.676 . . . . 0.0 111.001 177.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.77 -51.19 70.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.597 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.96 -46.62 96.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.97 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.505 HG11 HD11 ' A' ' 150' ' ' LEU . 65.4 t -62.45 -49.16 84.98 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.434 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.85 97.3 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.372 -0.442 . . . . 0.0 112.534 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.78 -44.2 97.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.699 0.285 . . . . 0.0 110.75 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -82.13 -29.81 31.46 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.104 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -58.89 -41.16 86.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.103 0.477 . . . . 0.0 110.498 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -77.52 9.45 3.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.503 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -131.4 14.88 5.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.528 0.204 . . . . 0.0 111.483 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.617 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 66.5 mt -80.73 119.29 75.75 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 120.69 0.281 . . . . 0.0 110.997 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.61 124.52 9.37 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.859 2.373 . . . . 0.0 111.118 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.567 HG22 ' HB3' ' B' ' 485' ' ' LEU . 11.2 p -142.44 128.46 17.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.458 0.647 . . . . 0.0 112.068 -173.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -98.66 127.55 44.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.128 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -54.5 -60.45 3.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 122.751 0.42 . . . . 0.0 112.13 -175.527 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -55.17 -57.3 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.89 -174.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -60.59 -44.21 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.622 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 94.9 m -66.13 -41.43 90.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.795 -176.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.19 -45.7 92.22 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 175.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.3 m -61.56 -41.15 96.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.256 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.3 m -62.52 -52.06 64.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.817 178.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 204' ' ' VAL . 71.2 t80 -57.98 -57.78 11.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.002 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.596 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 78.6 mt -54.46 -55.16 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -56.8 -40.27 75.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.092 -175.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.9 m -67.44 -48.86 66.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.482 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 200' ' ' PHE . 11.7 t -69.87 -22.55 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 120.936 0.398 . . . . 0.0 110.619 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 10.5 mmm180 -70.31 -27.31 64.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.208 173.641 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -94.08 -66.04 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.744 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -140.05 130.92 26.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.659 0.742 . . . . 0.0 109.593 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.716 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 59.7 mttp -83.33 57.44 3.99 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.879 -178.023 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 61.26 73.9 0.46 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -101.1 1.99 39.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.839 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 21.2 t -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.678 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -110.94 -59.23 1.99 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.855 -178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 45.6 tp -77.54 116.43 18.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.063 -176.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -109.3 121.71 45.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.995 178.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 64.94 90.4 0.09 Allowed 'General case' 0 N--CA 1.464 0.266 0 O-C-N 124.082 0.864 . . . . 0.0 111.55 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -86.05 125.67 33.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.242 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 24.7 m 58.47 54.3 5.63 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.587 0.554 . . . . 0.0 111.066 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -76.62 -19.43 77.94 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.909 -0.663 . . . . 0.0 111.946 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 30.1 m -63.69 133.2 29.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.993 0.425 . . . . 0.0 110.788 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.81 -0.614 . . . . 0.0 109.841 -178.234 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 N--CA 1.475 0.819 0 CA-C-O 120.732 0.301 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -76.27 -45.08 34.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 110.256 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -101.31 100.25 10.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.708 178.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 24.5 m -84.75 -32.87 23.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.376 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -128.89 157.55 41.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.046 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -134.83 129.3 34.28 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -97.73 -159.4 30.69 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.573 -177.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 9.7 p -80.83 -30.76 12.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.087 0.47 . . . . 0.0 110.477 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 179.91 167.09 36.52 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.913 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.6 t -90.96 -0.1 57.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.69 0.281 . . . . 0.0 110.865 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -59.34 -54.8 42.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.437 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 60.9 m -58.17 -31.53 67.35 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.408 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.5 tt -64.05 -49.69 71.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.683 176.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.486 ' O ' HG21 ' B' ' 471' ' ' VAL . 70.3 t80 -57.05 -56.39 22.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.332 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -62.87 -33.24 74.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -173.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.6 -44.19 82.79 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.068 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.92 -43.44 98.85 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.759 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.486 HG21 ' O ' ' B' ' 467' ' ' PHE . 86.0 t -58.6 -47.67 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 121.038 0.447 . . . . 0.0 110.817 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -39.51 81.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.423 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -76.92 -41.59 42.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.232 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.543 ' HB2' ' CZ ' ' B' ' 512' ' ' PHE . . . -70.31 -46.02 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.976 -174.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.23 -29.62 67.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.71 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 70.72 -60.43 0.5 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.006 0.816 . . . . 0.0 111.833 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 17.1 t -67.04 127.94 34.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.996 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.03 -23.05 64.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.709 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -75.08 -40.66 59.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.698 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.17 -42.26 84.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.228 176.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.499 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 65.4 t80 -65.81 -32.02 73.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.866 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.551 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 34.9 tt0 -64.47 -44.58 90.61 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 175.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.81 -44.81 78.21 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.412 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 81.9 t80 -55.43 -44.29 76.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.294 0.569 . . . . 0.0 109.978 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.567 ' HB3' HG22 ' A' ' 191' ' ' VAL . 89.3 mt -69.27 -31.19 69.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.354 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.617 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.1 OUTLIER -60.89 -44.06 97.61 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.041 0.448 . . . . 0.0 109.995 173.083 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.0 m -61.23 -36.79 80.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.199 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.53 HD21 ' CG ' ' A' ' 200' ' ' PHE . 45.6 mt -67.48 -47.6 69.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.463 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 14.3 m -65.19 -41.24 91.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.845 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.485 HG12 ' O ' ' B' ' 486' ' ' ARG . 16.1 pt -70.27 -32.94 52.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.944 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -63.68 -44.08 94.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -66.12 -34.01 77.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.533 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -87.79 21.98 2.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.856 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 63.3 25.24 14.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.025 0.441 . . . . 0.0 111.86 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.623 HG13 ' HA ' ' A' ' 161' ' ' TYR . 75.5 t -88.71 -48.47 14.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.34 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 44.1 pt -116.69 160.02 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.463 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.444 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 33.2 m -96.79 -174.0 2.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.18 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.716 ' HD2' ' HB3' ' A' ' 208' ' ' LYS . 20.5 mtp-105 -64.37 -53.35 50.07 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -176.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.21 -48.8 77.89 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -171.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.566 ' HA ' ' HG2' ' B' ' 503' ' ' GLN . 2.5 pm0 -66.29 -32.8 74.42 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.828 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.524 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -58.81 -44.72 90.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.824 0.345 . . . . 0.0 110.487 176.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.48 HG22 ' O ' ' B' ' 498' ' ' ARG . 0.3 OUTLIER -69.82 -41.49 79.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.671 -178.528 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.566 ' HG2' ' HA ' ' B' ' 500' ' ' GLU . 18.8 pt20 -73.71 -23.33 59.77 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -173.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 85.4 mt -66.8 -38.31 86.24 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.954 -0.466 . . . . 0.0 110.905 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.616 HG21 ' HG ' ' B' ' 509' ' ' LEU . 8.9 p -89.55 6.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.304 0.573 . . . . 0.0 110.599 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.489 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.5 t -61.14 -46.32 95.99 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.851 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.564 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 48.8 Cg_exo -58.63 -16.37 30.06 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.172 1.915 . . . . 0.0 112.765 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -99.95 -52.76 3.34 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.888 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.71 HD22 HD21 ' B' ' 515' ' ' LEU . 76.8 mt -92.09 0.86 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.634 -175.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.6 -17.17 68.61 Favored Glycine 0 C--O 1.23 -0.156 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.513 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.565 ' HD2' ' N ' ' B' ' 511' ' ' LYS . 3.2 mptp? -90.94 -3.54 57.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.388 0.614 . . . . 0.0 109.46 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.543 ' CZ ' ' HB2' ' B' ' 474' ' ' ALA . 43.4 m-85 -129.0 84.79 61.99 Favored Pre-proline 0 N--CA 1.448 -0.567 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.968 -174.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.95 -49.78 16.4 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.42 2.747 . . . . 0.0 112.893 -173.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.98 -34.03 75.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.385 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.71 HD21 HD22 ' B' ' 509' ' ' LEU . 9.8 tp -78.12 -43.78 27.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.377 -173.587 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.605 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 52.4 t80 -68.13 -37.31 80.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.091 178.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.42 -34.04 75.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.21 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -59.41 -48.47 81.5 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 175.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.489 ' O ' HD13 ' B' ' 523' ' ' LEU . 3.2 t80 -58.04 -44.03 87.15 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.185 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.605 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 88.7 mttt -60.16 -44.07 95.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.073 175.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -63.87 -39.51 94.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.508 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -70.55 -31.58 68.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.44 0.638 . . . . 0.0 110.045 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.524 HD21 HD23 ' B' ' 501' ' ' LEU . 10.6 mp -88.1 1.19 54.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.924 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 59.25 37.31 91.65 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.025 -178.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -101.39 114.17 27.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 110.944 -175.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.0 mttp -98.91 131.24 45.14 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.623 175.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.32 88.4 2.21 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 13.2 m . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.522 -0.752 . . . . 0.0 110.378 -178.179 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.33 0.11 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.4 t30 66.71 99.19 0.05 OUTLIER 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.263 0.554 . . . . 0.0 111.489 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 65.41 25.93 11.96 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.698 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -163.33 -172.15 30.46 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.314 -0.946 . . . . 0.0 112.717 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 39.7 t -139.31 120.09 14.3 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -121.74 160.52 24.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.92 138.32 45.44 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.875 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -107.46 18.22 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.237 0.542 . . . . 0.0 110.604 -175.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 88.0 164.41 40.2 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.835 -178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 151.7 -154.82 25.79 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.848 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -141.21 133.4 27.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 10.3 p -61.53 121.88 67.06 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 121.066 0.46 . . . . 0.0 111.474 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.68 175.09 9.34 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.795 2.33 . . . . 0.0 112.132 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.18 141.03 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 175.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -100.14 66.97 1.36 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.573 0.701 . . . . 0.0 110.813 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -90.98 -16.53 27.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.153 174.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.533 HG23 ' HG3' ' A' ' 146' ' ' PRO . 15.0 mt 66.03 132.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.501 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' B' ' 477' ' ' SER . 32.3 t70 -93.27 -56.0 3.11 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.532 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' THR . . . . . 0.418 ' HG1' ' C ' ' A' ' 144' ' ' ASP . 79.7 m -161.39 111.13 1.23 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.473 176.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.533 ' HG3' HG23 ' A' ' 143' ' ' ILE . 15.2 Cg_exo -68.59 142.98 55.14 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.823 2.349 . . . . 0.0 111.612 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -100.73 141.32 33.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.6 p -84.44 129.39 37.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 110.561 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.523 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 10.9 t70 -81.31 100.63 9.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.06 3.29 53.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.2 0.524 . . . . 0.0 110.668 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -76.6 -27.63 55.84 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.626 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.0 OUTLIER -51.82 -41.5 61.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.824 171.51 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.567 HD23 HD11 ' B' ' 504' ' ' LEU . 64.5 mt -61.01 128.19 35.23 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.837 -178.019 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -62.36 160.86 12.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.521 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.7 -44.18 69.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.122 0.486 . . . . 0.0 110.362 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.59 -37.97 88.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.057 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.422 HG21 HD22 ' A' ' 153' ' ' LEU . 10.6 m -64.35 -45.2 88.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.987 0.422 . . . . 0.0 110.556 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.589 HD12 ' HZ1' ' A' ' 175' ' ' LYS . 71.8 mt -59.86 -46.84 88.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.584 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -63.84 -34.94 79.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.84 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.532 ' HD3' ' O ' ' B' ' 494' ' ' GLU . 13.7 ttm180 -66.1 -46.47 77.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.561 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.584 ' HH ' HD11 ' A' ' 189' ' ' ILE . 83.7 t80 -52.52 -48.02 66.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.365 173.534 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.614 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 6.5 mtpm? -65.46 -34.78 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.427 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -75.27 -40.54 58.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.762 0.315 . . . . 0.0 111.032 -176.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -74.48 -43.71 54.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.804 0.335 . . . . 0.0 111.327 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.431 ' CE1' HG21 ' B' ' 490' ' ' ILE . 39.2 m-85 -85.48 0.24 52.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.353 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 57.39 73.12 0.48 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.433 176.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.614 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 76.0 mt -113.69 135.23 21.95 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.856 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.16 157.4 25.63 Favored 'Trans proline' 0 C--O 1.238 0.476 0 C-N-CA 123.243 2.629 . . . . 0.0 112.381 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.52 ' HB ' HD11 ' A' ' 173' ' ' LEU . 13.8 p -139.5 106.61 5.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.43 -178.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.9 ptp180 -64.35 150.31 93.23 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.182 175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.74 128.07 21.22 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.541 2.161 . . . . 0.0 111.812 177.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 100.41 57.25 0.89 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.775 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.52 HD11 ' HB ' ' A' ' 169' ' ' THR . 83.3 mt -83.78 142.71 30.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.297 0.57 . . . . 0.0 111.748 -179.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.704 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 14.0 m120 -138.54 179.75 6.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.033 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.589 ' HZ1' HD12 ' A' ' 158' ' ' LEU . 27.7 tptp -57.4 -53.45 58.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.881 0.372 . . . . 0.0 110.798 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.89 -27.84 67.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.295 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.704 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 31.5 mm-40 -67.77 -44.76 76.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.42 0.629 . . . . 0.0 110.154 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 91.2 mt -64.13 -42.71 96.72 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.837 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 67.9 t -60.66 -42.41 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.544 179.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 177' ' ' GLN . 8.0 pt-20 -67.94 -40.85 83.23 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.259 -177.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.4 ' N ' ' HG3' ' A' ' 180' ' ' GLU . 60.0 mt -67.46 -48.71 76.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 120.916 0.389 . . . . 0.0 110.257 176.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.21 -49.05 83.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.706 179.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.39 96.28 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.546 -177.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 46.7 t -59.05 -46.41 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.969 0.414 . . . . 0.0 110.619 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.77 -26.28 31.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.231 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.559 ' HE1' HD13 ' B' ' 490' ' ' ILE . 35.6 t80 -66.33 -34.85 78.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.176 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -78.33 10.23 3.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.611 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.9 p -136.09 38.82 2.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.948 0.404 . . . . 0.0 111.332 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.875 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 73.8 mt -102.39 115.75 63.98 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.436 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.86 113.22 2.92 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 122.669 2.246 . . . . 0.0 111.918 177.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.581 HG23 ' HB3' ' B' ' 485' ' ' LEU . 9.1 p -115.75 154.21 17.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.761 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -118.62 112.89 20.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.518 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 32.6 tt0 -51.3 -65.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -58.4 -48.9 79.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.571 0.224 . . . . 0.0 111.356 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.46 -45.76 78.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.837 -174.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.3 m -68.7 -37.37 79.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.848 -0.16 . . . . 0.0 110.903 -176.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 53.3 mt -60.73 -47.34 86.75 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 40.7 m -57.91 -47.2 83.52 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.644 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.4 -48.24 82.4 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.57 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.528 ' CG ' HD21 ' B' ' 488' ' ' LEU . 68.8 t80 -64.63 -47.95 76.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.285 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.457 HD12 ' HE2' ' B' ' 468' ' ' PHE . 78.8 mt -57.44 -44.62 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.021 -177.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -71.07 -35.0 71.73 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.185 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 73.8 m -60.89 -50.23 74.27 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.733 0.301 . . . . 0.0 110.866 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 200' ' ' PHE . 20.4 t -71.48 -33.51 49.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.064 -177.025 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -69.15 -27.04 65.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.456 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.74 -63.4 1.08 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -178.09 177.95 0.97 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.443 ' N ' ' HD2' ' A' ' 208' ' ' LYS . 11.0 mptt -101.7 118.72 37.51 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.749 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.39 114.61 3.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.522 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -161.07 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.739 -177.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 49.5 m 61.96 -176.15 0.13 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.244 0.545 . . . . 0.0 112.147 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -158.15 -45.43 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.324 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 67.3 tp -98.91 105.7 17.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.885 0.374 . . . . 0.0 110.551 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -120.65 11.74 11.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.627 0.727 . . . . 0.0 109.204 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -103.8 13.99 31.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.833 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -91.83 -47.94 7.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.022 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.8 m -82.05 84.83 6.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.731 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -90.58 -88.39 1.35 Allowed Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.231 -0.748 . . . . 0.0 111.231 176.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 14.7 p -94.49 -21.49 5.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.537 0.684 . . . . 0.0 109.343 175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.976 176.521 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.835 0.35 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -94.9 99.83 11.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.03 0.443 . . . . 0.0 110.665 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -120.06 -26.15 5.61 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.422 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 35.1 t -82.49 147.39 28.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.605 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -64.26 -36.26 83.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.226 0.536 . . . . 0.0 109.763 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -144.68 119.8 10.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.048 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -79.34 -171.68 41.62 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.43 -175.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . 0.666 HG12 ' HB2' ' B' ' 464' ' ' GLU . 59.5 t -90.54 121.04 40.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -133.27 -72.54 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.115 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 463' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.9 p -72.79 -25.3 61.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.695 0.283 . . . . 0.0 111.075 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.666 ' HB2' HG12 ' B' ' 461' ' ' VAL . 50.9 mp0 -62.93 -51.21 67.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.909 177.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 17.0 t -63.93 -33.32 75.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.95 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.439 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 42.7 tp -58.17 -53.9 53.07 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.169 175.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.441 ' O ' HG21 ' B' ' 471' ' ' VAL . 75.3 t80 -54.03 -55.07 30.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.925 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.457 ' HE2' HD12 ' A' ' 201' ' ' ILE . 31.6 m-85 -61.36 -39.5 90.85 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -174.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.8 -39.93 95.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.82 0.343 . . . . 0.0 110.337 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.3 mttt -63.01 -46.25 88.53 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.184 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.441 HG21 ' O ' ' B' ' 467' ' ' PHE . 85.5 t -57.09 -44.47 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.139 0.495 . . . . 0.0 110.521 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -58.43 -42.33 87.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.967 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -80.28 -44.86 18.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.035 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.506 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -61.88 -42.45 99.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . 0.46 ' C ' ' H ' ' B' ' 477' ' ' SER . 10.6 mp -71.57 -37.95 71.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.217 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 ttp85 70.48 -36.78 0.37 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.976 0.91 . . . . 0.0 111.935 177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.46 ' H ' ' C ' ' B' ' 475' ' ' LEU . 30.1 t -80.51 121.6 25.98 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.901 0.382 . . . . 0.0 110.875 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.95 72.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.706 177.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -63.34 -42.0 98.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.147 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.478 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -72.06 -40.98 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.243 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.541 ' O ' HD11 ' B' ' 485' ' ' LEU . 72.9 t80 -62.51 -45.01 94.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.395 0.617 . . . . 0.0 109.481 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.509 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 38.9 tt0 -57.29 -43.94 83.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.038 176.191 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -56.71 -43.92 81.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.801 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -54.77 -51.44 65.73 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.581 ' HB3' HG23 ' A' ' 191' ' ' VAL . 1.5 mp -66.01 -26.25 67.45 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.875 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.0 mtt85 -68.0 -37.35 81.36 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.801 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 47.6 m -63.08 -32.01 73.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.222 0.534 . . . . 0.0 109.741 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.528 HD21 ' CG ' ' A' ' 200' ' ' PHE . 72.0 mt -68.18 -45.71 72.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.356 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.425 HG21 ' HA ' ' B' ' 486' ' ' ARG . 19.4 m -66.01 -40.89 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.555 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.559 HD13 ' HE1' ' A' ' 186' ' ' PHE . 17.3 pt -69.66 -30.82 46.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -66.32 -42.15 88.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 110.006 174.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.6 -35.58 81.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.561 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -89.62 26.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.019 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . 0.532 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 12.4 pt-20 46.14 32.41 1.43 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.29 1.036 . . . . 0.0 112.649 177.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.467 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 63.8 t -81.76 -42.55 19.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.4 pt -116.13 175.87 2.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 16.3 m -115.15 174.95 5.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.065 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.446 ' O ' HG22 ' B' ' 502' ' ' VAL . 60.8 ttp180 -57.51 -52.39 65.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.506 0.193 . . . . 0.0 110.675 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.5 -46.61 83.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.834 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.532 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.8 mm-40 -56.02 -50.44 70.91 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.464 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.507 HD21 HD23 ' B' ' 523' ' ' LEU . 64.3 tp -59.79 -49.0 79.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.405 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.53 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 93.1 t -59.89 -38.52 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.626 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 16.2 mm100 -72.25 -38.91 68.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.413 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.567 HD11 HD23 ' A' ' 153' ' ' LEU . 65.6 mt -58.64 -37.55 76.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.448 HG21 ' HG ' ' B' ' 509' ' ' LEU . 5.1 p -91.22 6.01 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.056 0.455 . . . . 0.0 111.4 -175.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.61 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 93.4 p -63.07 -42.17 75.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.61 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 25.8 Cg_exo -65.96 -10.49 27.15 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.88 1.72 . . . . 0.0 112.367 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -99.16 -57.2 2.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.464 HD22 HD22 ' B' ' 515' ' ' LEU . 57.3 mt -92.49 3.04 56.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.811 -175.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.59 -22.58 71.67 Favored Glycine 0 N--CA 1.454 -0.12 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.966 -177.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -87.37 -2.42 58.6 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.506 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 46.3 m-85 -127.04 90.81 48.44 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.923 -176.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.45 -47.21 20.2 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.35 2.7 . . . . 0.0 113.282 -172.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.51 -32.72 66.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.898 0.38 . . . . 0.0 110.918 -176.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.464 HD22 HD22 ' B' ' 509' ' ' LEU . 15.8 tp -71.31 -43.74 66.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.072 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.51 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 28.5 t80 -66.61 -34.97 79.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.995 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -63.87 -39.85 95.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.648 175.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -58.1 -49.06 78.25 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.53 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 37.3 t80 -56.67 -45.86 81.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.763 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.51 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.0 mttt -58.87 -39.98 83.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.721 0.296 . . . . 0.0 111.471 178.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -71.22 -38.72 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.304 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -64.61 -45.34 87.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.849 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.507 HD23 HD21 ' B' ' 501' ' ' LEU . 5.6 mp -83.28 -2.72 56.34 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 64.51 52.32 44.28 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.772 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -65.87 93.3 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -87.07 116.57 25.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.707 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -95.55 20.39 9.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 -176.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.01 -179.765 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 46.6 m . . . . . 0 N--CA 1.477 0.912 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -116.66 -0.6 12.33 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.64 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -93.42 -9.27 39.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.283 0.563 . . . . 0.0 110.376 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 152.55 -109.95 0.43 Allowed Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.433 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 21.4 m 64.56 -174.35 0.17 Allowed 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.518 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -147.06 172.58 13.52 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.96 -11.3 42.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.0 0.429 . . . . 0.0 111.515 -171.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -100.52 -54.78 2.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.853 0.359 . . . . 0.0 111.053 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.79 62.96 0.1 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.051 -0.595 . . . . 0.0 111.673 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -80.18 -60.49 2.38 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.094 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 34.9 t70 62.4 98.06 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.111 0.565 . . . . 0.0 111.007 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.9 m 70.81 92.97 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.083 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.86 -32.18 18.64 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.708 2.272 . . . . 0.0 111.852 177.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.4 m -110.2 159.94 9.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.658 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -107.14 -162.29 0.83 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.845 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 63.89 46.3 3.95 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.375 0.607 . . . . 0.0 109.493 -174.591 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.24 136.76 22.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.945 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' B' ' 477' ' ' SER . 19.6 p-10 -80.16 -53.23 6.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.35 -0.386 . . . . 0.0 109.989 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 90.3 m -166.14 109.26 0.72 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.965 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_exo -71.35 158.72 53.65 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.252 1.968 . . . . 0.0 110.791 173.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -108.82 145.27 35.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.029 0.443 . . . . 0.0 111.339 -175.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.74 135.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.774 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -105.62 131.99 52.31 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 96.2 mt -110.28 5.9 22.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.145 0.497 . . . . 0.0 110.471 179.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -84.99 -24.19 28.36 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 -28.3 69.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.437 172.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.482 HD22 HD23 ' B' ' 504' ' ' LEU . 59.2 mt -63.75 158.16 22.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.104 0.478 . . . . 0.0 110.989 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . 0.407 HE21 ' CD ' ' B' ' 500' ' ' GLU . 46.6 mt-30 -78.78 148.95 32.76 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.454 177.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.508 HG12 ' CD1' ' A' ' 178' ' ' LEU . 85.6 t -53.96 -45.29 63.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 CA-C-O 121.198 0.523 . . . . 0.0 110.317 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -60.3 -36.6 78.26 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.631 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 26.7 m -68.23 -43.75 77.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.098 0.475 . . . . 0.0 110.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.408 HD21 HG21 ' A' ' 182' ' ' VAL . 88.0 mt -65.03 -38.54 91.22 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.352 0.596 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.45 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 79.9 mtp180 -70.72 -30.59 67.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.309 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.489 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 42.2 ttm105 -70.46 -42.76 71.05 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.62 ' HA ' HG11 ' B' ' 495' ' ' VAL . 52.2 t80 -48.86 -58.2 5.2 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.071 173.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.588 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 6.4 ptpp? -67.97 -27.37 66.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.71 -176.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -67.81 -51.62 46.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -67.31 -37.2 82.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.011 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -88.85 0.15 56.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt 59.69 74.94 0.42 Allowed 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.669 0.606 . . . . 0.0 111.984 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.588 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 82.5 mt -117.6 110.63 40.38 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.96 176.78 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.08 127.38 16.7 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.672 2.248 . . . . 0.0 112.129 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.532 ' HB ' HD12 ' A' ' 173' ' ' LEU . 30.7 p -124.35 163.8 20.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.987 0.422 . . . . 0.0 111.9 -175.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -92.35 151.93 41.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.066 179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.54 145.39 91.84 Favored 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.512 2.141 . . . . 0.0 112.172 178.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 78.94 48.34 7.08 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.223 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.532 HD12 ' HB ' ' A' ' 169' ' ' THR . 97.9 mt -74.75 150.08 39.53 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.93 0.395 . . . . 0.0 111.061 178.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.432 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 16.2 t-20 -120.37 167.24 12.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.472 ' HD3' HG23 ' A' ' 155' ' ' VAL . 21.7 tptm -54.38 -52.49 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.555 0.342 . . . . 0.0 111.29 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.48 -36.81 76.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.349 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.8 ' HA ' HE21 ' A' ' 177' ' ' GLN . 0.0 OUTLIER -64.42 -44.01 92.54 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.15 0.5 . . . . 0.0 110.167 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.559 HD21 ' HZ2' ' A' ' 162' ' ' LYS . 85.7 mt -62.38 -41.17 98.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.778 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 71.2 t -62.28 -43.98 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 123.622 0.576 . . . . 0.0 111.114 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 48.4 mt-10 -61.05 -44.74 96.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.789 0.328 . . . . 0.0 110.771 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.514 HD12 HG22 ' A' ' 169' ' ' THR . 72.5 mt -63.58 -50.62 77.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.581 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.408 HG21 HD21 ' A' ' 158' ' ' LEU . 69.1 t -61.03 -46.18 97.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.557 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.21 -40.61 99.28 Favored Glycine 0 N--CA 1.448 -0.546 0 O-C-N 123.368 0.417 . . . . 0.0 112.618 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -60.02 -43.31 95.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.358 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -78.87 -28.83 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.597 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.1 -29.98 70.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.537 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -80.75 0.41 34.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.11 176.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.8 t -126.1 24.81 6.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.892 0.377 . . . . 0.0 110.74 -175.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.83 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.4 mt -90.17 117.47 68.07 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.885 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.67 118.79 5.6 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.542 2.161 . . . . 0.0 111.157 174.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 8.8 p -133.42 154.93 39.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.486 -175.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -132.11 128.25 37.73 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.505 ' HG3' ' HE2' ' B' ' 481' ' ' TYR . 34.7 tt0 -51.98 -63.83 1.01 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.94 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -57.08 -53.74 54.69 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.038 0.447 . . . . 0.0 112.059 -174.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -65.61 -46.6 78.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.911 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.5 m -67.03 -36.7 82.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.375 -176.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.526 HD22 ' HH ' ' B' ' 481' ' ' TYR . 45.0 mt -60.64 -45.86 92.51 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 61.1 m -56.97 -45.54 82.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.741 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 62.5 m -60.08 -54.52 45.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.085 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.538 ' CD1' HD22 ' B' ' 488' ' ' LEU . 71.9 t80 -57.27 -48.29 79.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.278 -177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.48 ' O ' ' HB2' ' A' ' 205' ' ' ARG . 87.8 mt -61.0 -47.23 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.488 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -65.29 -36.45 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.188 -175.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -69.53 -61.22 1.87 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.853 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.22 -29.12 46.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -170.606 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.48 ' HB2' ' O ' ' A' ' 201' ' ' ILE . 11.7 mtp180 -79.63 -3.59 47.86 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -125.32 -65.64 1.0 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.417 . . . . 0.0 110.804 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -131.51 104.29 6.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.496 0.665 . . . . 0.0 110.178 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.7 89.57 6.76 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.519 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 67.1 86.22 0.13 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.524 -172.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.792 ' H ' ' HD2' ' A' ' 210' ' ' LYS . 0.0 OUTLIER -45.76 112.99 0.53 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.183 -175.865 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 24.7 m -149.73 -178.73 6.62 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.393 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -70.34 -34.57 72.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.638 0.256 . . . . 0.0 110.453 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 57.8 tp 68.51 -85.01 0.03 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.169 177.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt 179.44 117.51 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -178.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -108.86 135.02 50.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.707 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -105.81 87.35 2.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.318 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 31.4 m -113.64 158.04 21.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.212 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 112.03 -81.74 0.29 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.66 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 35.4 m -125.44 156.51 34.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.86 0.362 . . . . 0.0 110.396 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.668 -179.428 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.8 -14.31 48.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.041 176.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.21 111.82 21.38 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.895 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 17.8 m -94.22 -26.54 16.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.097 179.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -106.85 144.31 33.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.491 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 58.8 m170 60.41 40.2 17.61 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.184 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -76.79 48.5 2.66 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.047 -0.596 . . . . 0.0 112.521 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 17.3 m -126.08 22.63 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.197 0.522 . . . . 0.0 110.694 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -75.53 1.83 55.81 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.443 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 10.0 p -69.49 -25.69 64.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.632 0.253 . . . . 0.0 111.477 -179.084 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.459 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 0.8 OUTLIER -63.14 -47.46 82.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.096 176.341 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.6 m -60.24 -39.55 87.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.259 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 44.9 tp -59.08 -51.74 68.76 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.461 ' O ' HG21 ' B' ' 471' ' ' VAL . 81.6 t80 -53.89 -56.96 12.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.739 178.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -64.37 -36.58 84.61 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -173.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.45 -41.92 88.38 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.586 -0.446 . . . . 0.0 109.965 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -62.38 -43.95 97.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.067 178.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.603 HG13 HD23 ' B' ' 509' ' ' LEU . 86.7 t -59.96 -51.91 67.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.16 0.505 . . . . 0.0 110.782 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -58.7 -34.1 70.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.202 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . 0.448 ' HB2' ' HE3' ' B' ' 473' ' ' LYS . 36.9 ttmt -85.19 -31.93 22.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.511 -176.053 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.89 -39.6 30.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.644 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . 0.496 ' C ' ' H ' ' B' ' 477' ' ' SER . 66.0 mt -62.91 -35.65 80.77 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.934 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 71.81 -28.58 0.19 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.818 0.699 . . . . 0.0 111.836 178.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.496 ' H ' ' C ' ' B' ' 475' ' ' LEU . 1.2 p -96.09 120.39 36.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.058 -177.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.72 99.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -60.51 -35.16 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.084 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -71.51 -36.8 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 0.0 110.734 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.526 ' HH ' HD22 ' A' ' 197' ' ' LEU . 44.0 t80 -71.69 -34.57 69.76 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 42.6 tt0 -62.62 -43.03 99.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.709 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.67 -48.58 69.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.705 174.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.436 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 83.9 t80 -55.11 -48.73 73.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.525 176.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 95.3 mt -64.53 -32.21 73.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.644 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.83 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.6 mtt180 -68.89 -38.22 79.51 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.483 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.3 -35.49 75.71 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.013 0.435 . . . . 0.0 109.931 172.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.538 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -65.57 -52.19 54.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.067 179.067 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.468 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -61.81 -39.63 84.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.432 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.1 pt -69.83 -31.04 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.652 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -67.29 -38.22 84.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 109.97 171.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -72.79 -5.2 36.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.459 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -115.14 13.39 16.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.154 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 59.29 29.33 18.87 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.472 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.62 HG11 ' HA ' ' A' ' 161' ' ' TYR . 71.4 t -80.59 -51.03 16.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.1 0.476 . . . . 0.0 110.333 178.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.5 pt -108.51 167.15 4.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.15 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 27.0 t -101.34 177.75 4.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.949 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.555 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 52.5 ttp180 -59.01 -59.46 5.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.179 0.514 . . . . 0.0 110.685 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.35 -40.98 79.21 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.565 -179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.528 ' HA ' ' NE2' ' B' ' 503' ' ' GLN . 8.8 mm-40 -55.45 -42.81 74.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.103 0.477 . . . . 0.0 110.213 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 10.5 tt -64.84 -45.8 84.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.33 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.499 HG13 ' CZ ' ' B' ' 516' ' ' PHE . 0.1 OUTLIER -64.19 -32.51 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.516 -179.239 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.528 ' NE2' ' HA ' ' B' ' 500' ' ' GLU . 16.7 mt-30 -68.12 -43.13 79.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.145 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.482 HD23 HD22 ' A' ' 153' ' ' LEU . 49.3 mt -58.72 -43.51 90.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.106 -177.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.538 HG21 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -91.58 7.91 4.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.15 0.5 . . . . 0.0 111.038 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 20.6 t -59.5 -49.49 92.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.927 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 47.3 Cg_exo -59.68 -17.17 40.94 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.256 1.971 . . . . 0.0 112.898 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -95.9 -57.32 2.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.351 -175.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.648 HD22 HD21 ' B' ' 515' ' ' LEU . 53.2 mt -99.26 -9.4 23.68 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -173.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.16 -23.07 71.27 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.527 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.516 ' HZ2' ' HB3' ' B' ' 511' ' ' LYS . 0.8 OUTLIER -78.78 -5.1 52.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.667 178.276 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -122.12 92.46 48.87 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.783 177.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo -49.64 -48.0 20.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.606 2.871 . . . . 0.0 113.268 -176.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.84 -34.41 77.87 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.088 0.471 . . . . 0.0 111.095 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.648 HD21 HD22 ' B' ' 509' ' ' LEU . 12.9 tp -78.44 -43.8 26.31 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.016 -174.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.511 ' O ' ' HG2' ' B' ' 520' ' ' LYS . 11.8 t80 -69.75 -32.27 70.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.853 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . 0.411 ' O ' ' HB2' ' B' ' 520' ' ' LYS . 25.5 t-20 -66.33 -37.68 85.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.309 175.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.459 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 27.2 t90 -58.02 -46.98 84.41 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.3 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -38.5 87.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.93 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.511 ' HG2' ' O ' ' B' ' 516' ' ' PHE . 34.0 mmtp -53.27 -50.52 64.67 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.335 0.588 . . . . 0.0 110.168 174.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.54 -36.27 78.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.86 -175.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -72.78 -39.32 66.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.543 -174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.555 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 10.6 mp -81.53 -19.58 41.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.934 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 74.08 28.22 64.83 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.829 -0.908 . . . . 0.0 110.829 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -82.31 90.07 6.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.171 0.51 . . . . 0.0 110.284 -175.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -79.7 97.38 6.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.29 11.64 36.52 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 47.1 m . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.651 -179.433 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.803 0.335 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -113.82 149.46 34.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.198 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -148.66 159.26 44.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.277 177.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 104.69 -14.95 49.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.686 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.8 m -64.1 112.34 2.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.117 0.484 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -97.84 -25.38 15.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.498 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -94.49 142.78 27.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.356 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.44 63.27 2.13 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.015 0.822 . . . . 0.0 110.761 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -92.68 44.55 2.56 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.967 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -108.56 23.86 23.44 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.668 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.19 104.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.257 0.551 . . . . 0.0 110.618 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.3 m -133.25 101.84 13.31 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.174 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.21 -67.27 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.981 2.454 . . . . 0.0 112.126 178.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . 0.424 ' O ' HG13 ' A' ' 140' ' ' VAL . 10.8 t 64.26 22.64 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.997 0.903 . . . . 0.0 110.3 178.362 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . 0.5 ' HG3' ' HA ' ' B' ' 474' ' ' ALA . 78.9 mm-40 -110.95 113.79 26.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.736 178.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -79.19 -8.93 59.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.551 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.545 HG22 ' HG3' ' A' ' 146' ' ' PRO . 16.7 mt -58.64 134.76 23.49 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.231 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.498 ' O ' ' HB2' ' B' ' 477' ' ' SER . 26.8 t70 -90.91 -57.31 2.86 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.873 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' THR . . . . . 0.426 ' HG1' ' C ' ' A' ' 144' ' ' ASP . 82.2 m -165.61 104.58 0.74 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.773 -179.57 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.545 ' HG3' HG22 ' A' ' 143' ' ' ILE . 11.4 Cg_exo -69.68 155.18 66.88 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.711 2.274 . . . . 0.0 111.686 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -107.59 163.91 12.67 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.718 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.8 p -119.85 121.37 65.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.205 0.526 . . . . 0.0 110.819 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -74.2 118.61 17.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.073 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 62.5 mt -106.72 -6.9 17.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.96 0.41 . . . . 0.0 110.841 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.475 ' HA ' HG22 ' A' ' 179' ' ' VAL . 1.9 t80 -75.21 -14.29 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.393 0.615 . . . . 0.0 109.345 176.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.27 -24.64 59.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.9 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.547 HD21 HD22 ' B' ' 504' ' ' LEU . 29.7 mt -68.58 160.25 30.38 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.26 0.552 . . . . 0.0 111.42 -173.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.12 156.24 30.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.094 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.424 HG11 ' CD1' ' A' ' 178' ' ' LEU . 50.2 t -58.92 -44.27 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -56.97 -44.54 82.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.671 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.719 HG22 ' HG2' ' B' ' 500' ' ' GLU . 35.8 m -62.93 -48.38 79.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.112 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.579 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 95.5 mt -63.28 -44.61 94.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 50.5 mtp180 -65.18 -35.88 82.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.615 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -68.14 -43.82 77.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.612 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.535 ' HH ' HD12 ' A' ' 189' ' ' ILE . 62.1 t80 -53.26 -50.0 65.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.074 0.464 . . . . 0.0 110.302 174.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.547 ' NZ ' HD11 ' A' ' 181' ' ' ILE . 59.7 mtpt -67.83 -29.02 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.615 -177.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.418 ' O ' ' HD3' ' A' ' 166' ' ' LYS . 44.6 ttm180 -79.72 -43.64 22.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.629 0.252 . . . . 0.0 111.024 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -69.15 -42.66 75.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.737 0.304 . . . . 0.0 110.631 -177.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -84.28 -1.31 55.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.53 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . 0.418 ' HD3' ' O ' ' A' ' 163' ' ' ARG . 71.7 mmtt 58.35 66.74 1.04 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.464 178.29 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.509 HD11 HG21 ' A' ' 181' ' ' ILE . 94.6 mt -101.18 137.31 19.66 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.499 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.34 139.63 78.23 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.825 2.35 . . . . 0.0 111.953 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 37.6 p -131.65 147.27 52.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 67.4 mtt180 -114.37 145.56 34.0 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.31 129.04 33.07 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.894 2.396 . . . . 0.0 111.724 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 105.36 48.72 1.03 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.307 -176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 88.0 mt -83.16 144.5 29.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.362 0.601 . . . . 0.0 111.183 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.573 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 17.8 m120 -137.14 176.35 8.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.015 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -55.84 -48.73 74.97 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.386 0.429 . . . . 0.0 110.698 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.11 93.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.248 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.573 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 27.9 mm-40 -60.76 -40.42 92.43 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.454 0.645 . . . . 0.0 110.644 -178.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.579 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 81.7 mt -63.61 -51.88 63.33 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.745 177.432 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.475 HG22 ' HA ' ' A' ' 151' ' ' TYR . 96.7 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 123.622 0.576 . . . . 0.0 111.695 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.52 -49.18 77.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.465 -178.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.547 HD11 ' NZ ' ' A' ' 162' ' ' LYS . 65.8 mt -70.6 -42.88 78.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 -179.311 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.424 HG23 ' O ' ' A' ' 178' ' ' LEU . 56.0 t -59.26 -49.38 83.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.389 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.426 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.68 -37.54 94.51 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.424 -0.417 . . . . 0.0 112.661 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.9 t -57.9 -43.05 85.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.912 0.387 . . . . 0.0 110.586 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -86.65 -27.59 23.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.832 0.348 . . . . 0.0 111.17 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.504 ' HE1' HD11 ' B' ' 490' ' ' ILE . 50.3 t80 -61.77 -42.73 99.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 -176.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.411 ' HB3' ' HE3' ' A' ' 187' ' ' LYS . 30.3 mtpp -78.19 17.94 0.57 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 34.9 p -140.59 19.72 2.36 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.457 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.971 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 81.6 mt -78.7 124.03 85.25 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.96 140.55 42.18 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.252 1.968 . . . . 0.0 110.907 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.95 155.78 6.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.919 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -125.32 115.17 19.92 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.637 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.3 tt0 -47.78 -64.76 0.7 Allowed 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -172.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -64.7 -45.84 84.91 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -173.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.24 -41.54 89.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.769 0.319 . . . . 0.0 110.92 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.5 m -66.13 -40.16 90.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.917 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.637 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 50.0 mt -58.82 -46.68 87.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 55.8 m -56.04 -48.81 75.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.741 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 60.3 m -57.21 -55.23 37.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.236 177.289 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.627 ' CD1' HD23 ' B' ' 488' ' ' LEU . 41.6 t80 -52.03 -52.94 47.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.562 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.504 HD12 ' HE2' ' B' ' 468' ' ' PHE . 84.4 mt -56.71 -55.35 20.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.248 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.21 -29.74 63.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -173.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -63.81 -55.27 24.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.343 176.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.493 HG11 HD22 ' B' ' 523' ' ' LEU . 58.2 t -65.18 -32.21 57.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.637 -175.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.43 ' HD3' HG21 ' A' ' 201' ' ' ILE . 23.8 mtp180 -72.94 -5.29 37.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 112.168 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -122.7 -54.44 1.85 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.481 0.182 . . . . 0.0 111.379 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -127.8 167.87 15.93 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -140.2 13.29 2.41 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.165 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 63.97 6.87 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.786 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -134.39 42.51 2.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 29.5 m -97.6 -7.33 31.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -120.2 126.36 50.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.071 176.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . 0.41 HD12 ' N ' ' A' ' 213' ' ' LEU . 6.3 mp -109.27 -39.06 5.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.745 -174.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.04 82.89 3.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.632 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -95.28 129.42 42.42 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -81.2 -173.59 4.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.785 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 47.9 t -73.63 99.38 3.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.264 0.554 . . . . 0.0 111.033 -177.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -88.44 36.14 3.48 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.987 -0.625 . . . . 0.0 111.786 175.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 42.4 t -114.02 140.67 33.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.216 -0.897 . . . . 0.0 109.644 179.04 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 11.4 p . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.747 0.308 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -92.78 115.05 27.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.341 . . . . 0.0 110.68 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -135.56 129.83 33.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.44 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 14.4 m -120.45 173.51 7.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.272 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -101.1 131.78 46.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.029 0.442 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -133.53 147.8 51.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.979 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 71.08 -173.58 42.15 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.827 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 20.3 m -119.54 -169.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.718 0.294 . . . . 0.0 110.648 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 123.39 -2.09 9.59 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.948 -0.644 . . . . 0.0 111.543 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.0 p -86.11 -15.52 40.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.901 0.382 . . . . 0.0 110.732 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.468 ' HA ' ' CH2' ' B' ' 518' ' ' TRP . 3.4 mp0 -58.78 -43.53 90.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.752 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 15.9 m -63.57 -33.01 74.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.003 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 54.8 tp -65.59 -43.25 90.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.21 0.528 . . . . 0.0 109.862 177.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.443 ' O ' HG22 ' B' ' 471' ' ' VAL . 64.6 t80 -54.96 -49.19 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.994 173.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.504 ' HE2' HD12 ' A' ' 201' ' ' ILE . 31.1 m-85 -66.18 -32.07 73.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.77 -177.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.91 -46.31 91.17 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -60.91 -49.08 78.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.834 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.443 HG22 ' O ' ' B' ' 467' ' ' PHE . 92.5 t -59.49 -51.71 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.841 0.353 . . . . 0.0 111.345 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -58.97 -41.68 88.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.519 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . 0.464 ' HE3' ' HB2' ' B' ' 473' ' ' LYS . 21.9 ttmt -75.77 -34.35 60.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.317 -175.757 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.5 ' HA ' ' HG3' ' A' ' 141' ' ' GLN . . . -79.82 -41.27 26.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.716 -177.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.56 -41.96 87.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 121.101 -0.239 . . . . 0.0 110.831 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 40.2 ttt180 70.6 -56.12 0.61 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.847 0.717 . . . . 0.0 111.688 176.138 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.498 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 28.4 t -65.89 129.62 40.4 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.082 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.02 -40.95 87.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.946 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.88 -31.11 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 0.0 110.054 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.421 ' HB1' ' HD2' ' A' ' 146' ' ' PRO . . . -71.64 -43.51 65.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 177.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.491 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 76.8 t80 -65.54 -39.67 91.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 176.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.5 tt0 -60.09 -43.56 95.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.847 174.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.11 -44.7 75.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.821 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.46 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 51.2 t80 -57.53 -48.52 79.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.312 175.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -63.91 -33.1 74.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.171 -179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.971 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 20.0 mtt85 -66.12 -38.17 87.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.928 0.394 . . . . 0.0 110.452 177.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 53.7 m -62.03 -34.34 76.05 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 173.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.627 HD23 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -68.11 -46.85 69.78 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.412 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.45 HG21 ' HA ' ' B' ' 486' ' ' ARG . 15.6 m -64.85 -42.57 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.634 -178.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.504 HD11 ' HE1' ' A' ' 186' ' ' PHE . 22.9 pt -69.51 -29.59 42.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.848 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.33 -42.47 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.105 0.479 . . . . 0.0 109.889 172.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -67.26 -32.57 73.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.965 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.53 7.8 16.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 65.62 21.8 11.68 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.371 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.439 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 95.2 t -75.5 -43.07 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.973 0.416 . . . . 0.0 110.096 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.502 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 36.2 pt -120.17 154.96 23.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.717 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 28.3 p -98.99 -171.3 2.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.292 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.566 ' O ' HG23 ' B' ' 502' ' ' VAL . 45.2 ttp180 -55.77 -42.12 75.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.419 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -60.23 -53.4 58.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.571 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.719 ' HG2' HG22 ' A' ' 157' ' ' THR . 2.3 mp0 -60.63 -41.72 95.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.78 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.51 -41.99 86.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.763 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.566 HG23 ' O ' ' B' ' 498' ' ' ARG . 67.3 t -69.4 -40.71 80.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.894 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -74.68 -41.65 59.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.176 -175.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.547 HD22 HD21 ' A' ' 153' ' ' LEU . 91.0 mt -61.26 -36.92 81.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 111.636 -175.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.746 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -92.16 6.81 5.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.969 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.528 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 34.9 t -59.77 -48.33 95.37 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.737 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 24.0 Cg_exo -66.3 -1.56 5.69 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.946 1.764 . . . . 0.0 112.731 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.65 -61.68 1.61 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.764 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.746 ' HG ' HG22 ' B' ' 505' ' ' VAL . 48.1 mt -89.35 -21.16 23.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.151 -175.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -70.44 -10.18 66.02 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.452 -177.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -79.9 -11.83 59.78 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.422 ' HB2' ' HB3' ' B' ' 515' ' ' LEU . 60.5 m-85 -124.95 104.33 30.0 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.054 -178.395 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.13 -50.45 13.36 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.523 2.815 . . . . 0.0 113.586 -175.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -66.51 -41.47 88.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.095 0.474 . . . . 0.0 110.665 -177.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.422 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 22.2 tp -67.0 -45.71 76.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.727 -175.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -67.28 -32.34 73.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.351 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.15 -47.49 79.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.463 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.468 ' CH2' ' HA ' ' B' ' 464' ' ' GLU . 4.9 t90 -57.16 -48.56 78.4 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.753 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.507 ' CZ ' HD13 ' B' ' 523' ' ' LEU . 39.5 t80 -56.82 -50.69 71.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.495 -178.105 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.2 -38.29 90.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.2 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -44.42 91.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.586 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -63.03 -41.38 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.633 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.507 HD13 ' CZ ' ' B' ' 519' ' ' PHE . 88.7 mt -71.08 -26.64 63.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.489 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.55 33.87 15.32 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -173.374 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -90.65 90.81 8.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -97.35 29.03 3.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.179 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 67.62 18.51 9.91 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.145 -177.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 528' ' ' SER . . . . . 0.404 ' C ' HH22 ' B' ' 498' ' ' ARG . 17.0 m . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.583 -0.722 . . . . 0.0 109.835 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.475 0.798 0 CA-C-O 120.877 0.37 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -78.11 130.97 37.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.479 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -158.3 143.31 16.41 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.33 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 92.12 -154.94 22.68 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.179 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.0 p -91.05 155.31 18.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -89.49 -58.25 2.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.113 0.482 . . . . 0.0 110.294 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -103.77 142.0 35.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.555 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -106.62 152.04 24.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.934 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 138.06 -46.56 0.98 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.357 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 67.8 -97.09 0.4 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.971 -178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -128.36 106.41 8.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 49.4 m -152.65 142.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.861 179.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -76.94 170.93 18.89 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.605 2.203 . . . . 0.0 111.567 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 15.3 m -68.93 127.98 31.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.836 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 61.28 92.86 0.05 OUTLIER 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.349 0.595 . . . . 0.0 111.542 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.22 -20.25 27.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.97 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 4.2 pt -136.17 135.49 49.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.527 176.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.624 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.2 t70 -81.43 -64.19 1.24 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.1 m -151.42 96.24 3.24 Favored Pre-proline 0 N--CA 1.452 -0.344 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.303 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.532 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 53.7 Cg_exo -54.09 147.94 41.77 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.699 2.266 . . . . 0.0 112.131 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -126.64 149.72 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.122 0.487 . . . . 0.0 111.111 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.617 HG22 HD22 ' B' ' 483' ' ' ASN . 0.8 OUTLIER -95.47 138.73 20.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.915 -175.544 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.46 -46.87 68.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.831 0.824 . . . . 0.0 109.787 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.548 HD22 HD23 ' B' ' 504' ' ' LEU . 40.2 mt 60.28 10.04 2.2 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.527 -1.67 . . . . 0.0 111.553 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -94.03 -10.96 31.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -70.39 -29.95 66.72 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.609 HD21 HD13 ' B' ' 504' ' ' LEU . 19.2 mt -59.31 131.62 51.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.219 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -72.29 163.61 27.67 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.914 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.54 -44.17 80.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.758 0.313 . . . . 0.0 110.744 -178.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . 0.459 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 24.8 p30 -61.77 -35.43 78.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 48.1 m -71.78 -46.84 57.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.693 0.282 . . . . 0.0 110.97 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.62 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 88.1 mt -60.84 -46.82 89.05 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.226 0.536 . . . . 0.0 110.46 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 162' ' ' LYS . 29.5 mtp180 -65.12 -31.83 73.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.677 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.46 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.3 ttm180 -67.24 -46.81 72.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.266 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.555 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 57.8 t80 -52.94 -49.76 65.36 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.025 0.44 . . . . 0.0 110.335 174.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.527 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 7.9 mtpm? -57.7 -45.35 85.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.881 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -81.91 -31.7 31.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.514 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.515 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 45.4 t-80 -72.57 -37.99 68.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.556 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -88.41 -8.07 55.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.239 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm 61.33 69.99 0.63 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.766 0.666 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.46 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 84.9 mt -105.93 145.15 30.34 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.233 -178.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 21.5 Cg_exo -65.68 150.73 86.03 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.182 2.588 . . . . 0.0 111.928 176.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.471 HG22 ' HZ2' ' A' ' 162' ' ' LYS . 18.7 p -136.55 167.4 21.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.092 0.473 . . . . 0.0 112.115 -175.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 -121.18 151.9 56.32 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.462 176.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -66.45 134.41 35.74 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.231 1.954 . . . . 0.0 111.763 174.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.01 39.89 3.93 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.081 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.55 143.83 53.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.136 0.493 . . . . 0.0 111.314 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.661 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 26.9 m-80 -141.66 177.34 8.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.589 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -56.78 -52.11 66.32 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.182 0.301 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.9 -30.03 69.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.736 0.303 . . . . 0.0 110.847 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.661 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 25.4 mm-40 -64.58 -42.54 95.56 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.146 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.65 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 75.3 mt -62.72 -46.97 85.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.056 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.79 -46.03 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.281 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -60.1 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.45 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.2 -49.54 80.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.481 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.6 t -59.13 -49.47 83.24 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.91 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.31 92.12 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 121.49 -0.386 . . . . 0.0 112.835 -176.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.48 -48.97 79.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -80.77 -26.14 37.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.034 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.555 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 28.9 t80 -57.28 -48.59 78.52 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 -179.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.9 45.95 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 0.0 111.417 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 61.7 m -152.02 11.38 0.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.196 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.779 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 79.1 mt -89.34 120.93 69.75 Favored Pre-proline 0 C--O 1.234 0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.619 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.08 148.07 49.86 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.836 2.357 . . . . 0.0 111.732 177.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.26 129.8 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 0.0 111.327 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -91.44 119.63 31.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 169.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.536 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 42.4 tt0 -51.63 -54.17 30.72 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.388 0.43 . . . . 0.0 111.474 -173.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -59.24 -51.47 69.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -62.85 -43.94 97.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.328 -176.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 196' ' ' THR . . . . . 0.426 HG22 ' HB3' ' B' ' 485' ' ' LEU . 19.9 m -66.34 -42.69 87.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.299 -176.764 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.536 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 80.3 mt -62.98 -41.82 99.66 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 28.3 m -57.46 -46.23 83.87 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.375 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 95.0 m -56.87 -56.19 24.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.478 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.51 ' CG ' HD21 ' B' ' 488' ' ' LEU . 56.1 t80 -62.72 -55.5 26.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.603 -175.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 67.4 mt -56.43 -55.67 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.231 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.89 -34.82 78.62 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -173.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -64.99 -51.63 60.65 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.724 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.513 HG11 HD11 ' B' ' 523' ' ' LEU . 44.4 t -68.92 -28.72 40.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -63.7 -21.11 66.23 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.986 0.422 . . . . 0.0 111.05 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -106.14 -64.55 1.15 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.292 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.29 137.19 28.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.158 -173.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.71 39.88 1.12 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.293 0.568 . . . . 0.0 109.599 175.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 18.6 m120 63.33 -96.9 0.06 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.007 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 17.5 pttm -155.21 19.85 0.42 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.464 0.65 . . . . 0.0 109.698 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 211' ' ' SER . . . . . 0.402 ' HB2' ' HB3' ' B' ' 497' ' ' SER . 39.1 t -90.58 -8.57 49.86 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.876 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.637 ' HA ' ' NH2' ' B' ' 498' ' ' ARG . 6.9 p-10 -96.03 -5.73 40.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.035 -177.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.8 129.46 39.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -123.3 113.69 19.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.493 -176.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -95.26 -162.16 0.93 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.387 173.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.22 114.39 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 18.0 p -80.92 -33.74 33.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.241 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -177.67 -90.55 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.698 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 59.3 t 71.93 113.26 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-O 121.417 0.627 . . . . 0.0 110.726 -176.283 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 . . . . . 0 C--O 1.241 0.644 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.186 -176.002 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 110.245 -0.279 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -77.29 -23.26 51.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.187 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.75 -58.89 6.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.712 0.291 . . . . 0.0 110.561 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 20.2 m -92.12 76.94 5.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.132 176.174 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . 0.433 ' HD3' ' H ' ' B' ' 458' ' ' LYS . 0.3 OUTLIER -74.85 155.49 37.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.465 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -100.27 162.54 12.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.834 0.35 . . . . 0.0 110.571 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 162.28 178.86 36.51 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.9 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 29.1 m -122.64 162.39 22.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.597 0.237 . . . . 0.0 110.534 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 95.89 7.08 58.93 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.691 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.2 t -90.14 -19.57 24.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.634 0.254 . . . . 0.0 110.608 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.465 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -63.58 -38.66 91.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.833 0.349 . . . . 0.0 110.627 177.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 9.9 m -59.26 -43.71 92.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.244 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.73 -48.42 81.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.896 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.479 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.2 t80 -53.48 -52.9 58.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.06 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.465 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.0 m-85 -70.18 -28.93 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -174.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.21 -40.79 82.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -57.95 -50.27 73.95 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.368 172.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.479 HG23 ' O ' ' B' ' 467' ' ' PHE . 84.1 t -54.51 -42.23 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.869 0.366 . . . . 0.0 110.976 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -54.93 -51.57 65.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.313 177.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -78.46 -33.23 48.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.834 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.722 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -70.37 -45.84 65.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.75 -30.67 68.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.679 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 13.3 mtp180 68.94 -51.95 0.58 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.683 0.793 . . . . 0.0 112.427 173.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.624 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 29.4 t -78.77 137.8 37.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.882 -178.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.98 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.594 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.12 -38.77 91.72 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.532 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -66.16 -47.3 74.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.975 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.443 ' CE2' HD12 ' B' ' 485' ' ' LEU . 91.3 t80 -65.62 -42.92 91.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.543 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.596 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.1 tt0 -59.43 -40.81 87.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.676 177.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.617 HD22 HG22 ' A' ' 148' ' ' VAL . 3.0 t30 -57.93 -47.61 82.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.686 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -51.73 -49.91 61.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.95 174.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.443 HD12 ' CE2' ' B' ' 481' ' ' TYR . 71.7 mt -63.05 -34.37 77.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.22 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.779 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.2 mtt85 -66.52 -36.54 82.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 51.4 m -61.44 -36.42 80.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.23 0.538 . . . . 0.0 109.657 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.51 HD21 ' CG ' ' A' ' 200' ' ' PHE . 61.9 mt -66.11 -47.74 73.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.569 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.572 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.5 m -65.77 -42.16 91.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -176.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.465 HG12 ' O ' ' B' ' 486' ' ' ARG . 22.7 pt -68.48 -31.39 51.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.601 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.18 -42.02 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.291 0.567 . . . . 0.0 110.02 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -65.95 -31.36 72.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.759 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . 0.572 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 77.1 mt-30 -90.39 15.03 11.36 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.552 -177.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 68.75 10.93 8.17 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.128 0.571 . . . . 0.0 112.226 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.46 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 90.0 t -68.85 -55.51 15.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.089 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.431 HG12 HG13 ' B' ' 490' ' ' ILE . 42.3 pt -111.83 152.45 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.428 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 58.2 m -102.5 -177.28 3.35 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.784 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.637 ' NH2' ' HA ' ' A' ' 212' ' ' ASP . 40.2 ttp180 -57.25 -45.94 83.5 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.643 -175.406 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.89 -51.03 71.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.776 0.322 . . . . 0.0 111.036 -178.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.556 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.7 mp0 -60.21 -44.33 95.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 179.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.47 -46.85 80.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.067 0.461 . . . . 0.0 110.955 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.572 HG22 ' O ' ' B' ' 498' ' ' ARG . 88.5 t -63.1 -35.91 73.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.883 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -77.56 -30.02 52.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.609 HD13 HD21 ' A' ' 153' ' ' LEU . 86.2 mt -71.21 -39.72 71.58 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.29 7.1 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.255 0.55 . . . . 0.0 110.864 -177.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.637 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 31.7 t -57.95 -52.75 72.16 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.721 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.637 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.0 Cg_exo -66.67 -3.39 9.16 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.286 1.991 . . . . 0.0 112.931 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.567 ' CZ ' HG21 ' A' ' 148' ' ' VAL . 95.8 m-85 -109.27 -53.78 2.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.425 -175.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.528 HD21 HD22 ' B' ' 515' ' ' LEU . 87.1 mt -107.1 -6.42 17.41 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -176.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.03 -15.61 69.71 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.006 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.423 ' HG3' ' CE2' ' B' ' 512' ' ' PHE . 0.0 OUTLIER -84.75 1.97 44.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.523 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.722 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 87.9 m-85 -128.54 93.33 38.29 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.853 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.0 Cg_endo -52.55 -54.08 5.78 Favored 'Trans proline' 0 CA--C 1.528 0.198 0 C-N-CA 123.537 2.825 . . . . 0.0 113.345 -173.74 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -66.94 -33.26 75.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 0.0 111.207 -176.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.528 HD22 HD21 ' B' ' 509' ' ' LEU . 16.3 tp -74.84 -39.16 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 110.26 -178.123 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -70.15 -30.31 67.43 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 176.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.31 -45.19 95.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.851 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.465 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 19.0 t90 -56.23 -48.41 76.54 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.744 176.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -47.04 76.99 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.537 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.2 -39.82 91.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -66.46 -37.36 84.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.047 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -71.86 -35.12 69.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.112 0.482 . . . . 0.0 110.395 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.513 HD11 HG11 ' A' ' 204' ' ' VAL . 5.2 mp -86.92 -7.15 58.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.492 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.72 40.27 97.84 Favored Glycine 0 N--CA 1.452 -0.248 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 -175.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -79.08 96.02 5.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.1 0.476 . . . . 0.0 110.675 -173.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -84.27 144.32 28.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.021 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -92.68 -1.14 57.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.38 0.61 . . . . 0.0 110.608 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 C--O 1.25 1.111 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.527 -178.094 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 120.832 0.349 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -78.15 -21.36 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.342 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.98 -61.23 0.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.488 0.715 . . . . 0.0 111.473 -178.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 83.36 26.39 43.7 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.494 -177.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.2 t -146.12 149.16 33.5 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.0 t70 67.95 75.69 0.28 Allowed 'General case' 0 C--N 1.33 -0.257 0 O-C-N 124.247 0.967 . . . . 0.0 111.098 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -114.64 -25.34 8.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.052 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -85.37 174.58 9.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.864 177.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 112.87 -145.76 18.25 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.435 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 92.09 -87.51 1.29 Allowed Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.385 -176.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.447 ' HB3' ' H ' ' A' ' 138' ' ' SER . 4.3 m-20 57.77 -155.07 0.34 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.447 ' H ' ' HB3' ' A' ' 137' ' ' ASP . 19.9 m 71.01 130.7 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 123.086 0.554 . . . . 0.0 110.902 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -45.65 -71.12 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.197 2.598 . . . . 0.0 112.877 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 21.7 t 45.44 76.31 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 121.577 0.703 . . . . 0.0 111.452 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -94.84 133.96 37.99 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.236 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.567 ' O ' HG23 ' A' ' 143' ' ' ILE . 7.7 m-20 52.87 -108.91 0.44 Allowed 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 123.819 0.699 . . . . 0.0 109.474 -177.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.567 HG23 ' O ' ' A' ' 142' ' ' ASP . 1.4 pt -163.37 120.75 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 O-C-N 123.498 0.499 . . . . 0.0 110.729 175.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.548 ' HA ' ' NH1' ' B' ' 476' ' ' ARG . 31.3 t70 -78.4 -51.56 9.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 86.8 m -157.92 103.11 1.76 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.207 175.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.528 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 4.5 Cg_exo -74.29 165.22 32.34 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.628 2.218 . . . . 0.0 111.394 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -120.66 152.62 37.96 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.958 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.17 124.83 53.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.136 0.493 . . . . 0.0 110.957 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -81.65 107.06 14.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.772 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.415 HD21 HD23 ' B' ' 504' ' ' LEU . 81.5 mt -91.96 5.27 50.71 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.831 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -80.47 -17.44 51.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -64.68 -27.42 68.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.619 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.535 HD23 HD13 ' B' ' 504' ' ' LEU . 52.1 mt -69.98 142.69 52.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.036 -176.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -70.5 158.14 36.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.073 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.5 t -58.29 -43.1 85.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 110.145 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.99 -40.05 91.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.344 178.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 16.6 m -65.89 -42.8 89.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.107 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 91.8 mt -65.06 -42.01 94.62 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.978 0.418 . . . . 0.0 110.814 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.42 -35.93 82.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.977 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.7 ttm180 -63.66 -39.94 95.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.085 -179.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.482 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 54.3 t80 -60.51 -52.27 65.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.544 173.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.826 ' HZ2' HG23 ' A' ' 181' ' ' ILE . 19.9 mtpp -66.35 -28.69 68.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.069 -175.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -80.04 -39.52 29.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.092 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -70.64 -40.67 72.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.597 0.237 . . . . 0.0 111.232 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -88.6 -0.4 57.22 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.493 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 55.99 82.37 0.11 Allowed 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.677 0.61 . . . . 0.0 111.922 176.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.606 HD12 ' HG2' ' A' ' 162' ' ' LYS . 93.2 mt -114.53 134.1 22.4 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.478 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.61 127.81 7.43 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.527 2.152 . . . . 0.0 112.254 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.512 HG21 ' HZ1' ' A' ' 162' ' ' LYS . 10.6 t -173.38 158.29 3.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.258 178.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . 0.4 ' HD2' ' C ' ' A' ' 170' ' ' ARG . 7.5 ppt_? -83.13 153.98 66.72 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.92 157.44 54.8 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.511 2.14 . . . . 0.0 112.658 -178.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.05 25.84 20.84 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.663 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 64.2 mt -73.68 144.23 45.9 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.946 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 16.7 m120 -80.21 168.21 19.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.773 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.653 ' O ' HG21 ' A' ' 179' ' ' VAL . 17.8 tptm -55.88 -54.52 43.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.519 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.02 73.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.946 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 5.8 mm100 -69.22 -40.85 77.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.013 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.459 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 94.5 mt -59.83 -44.66 93.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.883 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.653 HG21 ' O ' ' A' ' 175' ' ' LYS . 37.6 t -57.67 -43.05 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.067 -178.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.03 -48.43 78.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.1 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.826 HG23 ' HZ2' ' A' ' 162' ' ' LYS . 67.8 mt -61.93 -46.27 96.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 CA-C-O 120.947 0.403 . . . . 0.0 110.687 179.052 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 66.7 t -59.39 -48.6 86.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.368 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.409 178.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -58.82 -46.76 93.05 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.376 -0.44 . . . . 0.0 112.714 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.98 -45.64 78.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.928 0.394 . . . . 0.0 111.231 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -79.48 -29.96 41.88 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.923 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.482 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 28.0 t80 -63.47 -43.47 97.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.787 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -68.07 -15.58 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 111.198 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 m -99.33 10.18 41.91 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.566 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.607 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.2 mt -83.26 118.98 73.23 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-O 120.651 0.262 . . . . 0.0 111.185 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.09 114.2 3.54 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.104 2.536 . . . . 0.0 110.925 173.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.03 138.28 52.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.128 0.49 . . . . 0.0 111.241 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -100.28 142.15 32.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.855 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.681 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.7 tt0 -63.59 -64.32 0.93 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.43 -50.08 68.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.19 -171.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -55.62 -39.75 71.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.468 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 37.1 m -75.3 -36.81 61.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.072 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 21.8 mt -60.29 -48.13 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 176.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 63.6 m -59.19 -42.67 91.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 68.5 m -56.54 -55.79 29.41 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.187 0.518 . . . . 0.0 111.696 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.72 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 46.6 t80 -63.44 -48.03 79.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.109 -176.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 82.6 mt -57.61 -52.82 52.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -58.59 -37.67 76.31 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 33.1 m -60.66 -52.26 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.884 0.373 . . . . 0.0 110.74 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.592 ' HA ' ' O ' ' A' ' 207' ' ' ASP . 18.9 t -76.54 -24.5 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.915 -174.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.427 ' HD3' HG21 ' B' ' 461' ' ' VAL . 0.4 OUTLIER -67.63 -21.56 65.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.413 . . . . 0.0 110.978 177.788 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -105.54 -47.35 3.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.839 0.352 . . . . 0.0 111.027 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.592 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 3.8 p30 -150.69 -156.15 0.69 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.817 -177.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -133.82 16.08 3.93 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -177.92 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.421 0.451 . . . . 0.0 110.347 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.455 ' HB3' ' NZ ' ' A' ' 210' ' ' LYS . 5.1 ttpm? -165.72 144.77 6.22 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.028 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 2.9 p -82.18 172.96 12.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.12 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.67 92.62 4.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.747 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 4.3 pp -146.4 148.69 32.57 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.122 178.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -123.02 41.99 3.32 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.191 0.519 . . . . 0.0 110.098 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -82.53 12.83 4.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.328 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -86.39 116.57 24.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 111.034 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 69.3 m -124.39 20.81 8.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.001 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 134.79 155.97 7.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.322 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 27.2 m -62.1 142.6 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.055 0.455 . . . . 0.0 110.959 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 40.0 m80 . . . . . 0 C--O 1.245 0.864 0 CA-C-O 118.473 -0.775 . . . . 0.0 109.99 -177.445 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.486 0.184 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -148.19 159.22 44.18 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -68.77 177.38 2.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 0.0 111.976 -177.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 13.2 t -78.92 174.24 11.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.146 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -124.37 166.37 16.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.543 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -110.87 15.35 21.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.21 0.528 . . . . 0.0 110.354 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -148.0 -172.46 18.03 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.583 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . 0.427 HG21 ' HD3' ' A' ' 205' ' ' ARG . 61.3 t -84.74 -48.18 16.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.845 0.355 . . . . 0.0 110.415 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -158.46 -95.99 0.11 Allowed Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.65 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 2.8 p -90.32 -4.29 57.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -61.17 -40.33 93.51 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.098 0.408 . . . . 0.0 111.063 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 68.4 m -63.12 -34.05 76.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.906 0.384 . . . . 0.0 110.486 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.64 -47.45 69.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.583 ' O ' HG23 ' B' ' 471' ' ' VAL . 74.9 t80 -52.59 -59.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.427 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.72 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 58.6 m-85 -63.55 -39.37 94.24 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -174.189 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.79 -41.41 95.84 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.991 0.424 . . . . 0.0 110.186 177.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.2 -42.32 93.66 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.326 178.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.583 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.9 t -60.67 -51.35 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-O 120.955 0.407 . . . . 0.0 110.204 175.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -55.04 -34.85 63.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.454 -177.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -87.06 -51.03 6.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.818 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -71.39 -25.54 62.4 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -172.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' B' ' 475' ' ' LEU . 12.1 tp -70.44 -19.76 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . 0.548 ' NH1' ' HA ' ' A' ' 144' ' ' ASP . 2.4 tmt_? 73.59 -43.39 0.55 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 124.071 0.857 . . . . 0.0 111.497 173.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 26.1 t -97.99 125.15 42.79 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.939 0.399 . . . . 0.0 111.273 -177.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -70.76 -27.8 64.2 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.806 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -65.16 -44.24 89.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.604 176.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.528 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -65.25 -40.0 93.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.599 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.482 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.842 176.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.41 ' HG2' ' HE ' ' B' ' 486' ' ' ARG . 27.5 tt0 -58.57 -44.21 89.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.251 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.45 -40.95 98.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.699 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.65 -47.56 81.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.31 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 83.3 mt -66.07 -30.55 71.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.028 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.607 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.9 mtm105 -68.92 -38.31 79.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.804 0.335 . . . . 0.0 110.793 176.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 55.8 m -60.74 -34.09 73.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.195 0.521 . . . . 0.0 109.857 171.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.524 HD23 ' CD1' ' A' ' 200' ' ' PHE . 31.8 mt -69.11 -45.62 69.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.917 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.438 HG21 ' HA ' ' B' ' 486' ' ' ARG . 24.3 m -62.9 -44.6 99.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.102 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.481 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 43.6 pt -67.1 -30.46 49.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.941 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -62.27 -45.09 94.84 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.185 0.517 . . . . 0.0 110.31 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -73.33 -29.23 62.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.079 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -81.6 12.77 3.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.448 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 64.52 27.58 13.41 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.032 0.444 . . . . 0.0 111.148 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.569 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.6 t -87.66 -46.85 15.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.653 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.411 HG12 HG13 ' B' ' 490' ' ' ILE . 48.0 pt -120.02 160.96 19.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.231 178.086 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.8 t -100.77 178.44 4.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.104 177.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.578 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 35.1 ttp180 -54.44 -52.39 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -50.97 -52.91 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.66 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.432 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.2 mp0 -58.29 -47.41 83.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.999 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.6 tp -55.29 -45.64 76.21 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.071 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.558 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 58.2 t -63.52 -38.54 82.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.965 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -74.99 -38.22 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.685 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.535 HD13 HD23 ' A' ' 153' ' ' LEU . 90.1 mt -62.33 -37.16 84.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.785 0.326 . . . . 0.0 111.813 -176.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.45 HG21 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -88.78 2.77 6.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.03 0.443 . . . . 0.0 111.183 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.529 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 28.2 t -59.07 -49.23 94.27 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.084 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.529 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 51.5 Cg_exo -55.91 -23.93 45.28 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 121.785 1.657 . . . . 0.0 112.571 176.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -87.88 -64.57 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.029 -177.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.629 HD23 HD23 ' B' ' 515' ' ' LEU . 64.7 mt -89.47 3.07 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.785 -172.563 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.43 -27.46 70.84 Favored Glycine 0 N--CA 1.453 -0.174 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.488 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -87.02 1.35 53.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.754 0.311 . . . . 0.0 110.801 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -125.3 85.5 58.27 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.971 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.19 -54.88 3.99 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.154 2.569 . . . . 0.0 113.56 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -62.88 -31.88 73.02 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 111.376 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.629 HD23 HD23 ' B' ' 509' ' ' LEU . 20.9 tp -76.67 -42.04 43.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.281 0.562 . . . . 0.0 110.218 -177.12 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.422 ' HD1' ' HB2' ' B' ' 509' ' ' LEU . 32.1 t80 -70.97 -34.37 71.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.092 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -71.58 -30.51 65.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.724 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -61.44 -48.1 82.68 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.558 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 34.6 t80 -54.96 -43.24 73.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.357 177.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.405 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.3 mttt -62.52 -46.46 88.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.109 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -60.36 -42.17 95.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.756 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -66.7 -41.21 88.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 -176.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.578 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 9.5 mp -82.75 -4.6 58.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.667 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 63.88 37.18 94.28 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.261 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -88.87 112.31 23.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.084 -175.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -125.32 125.25 43.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.58 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -81.63 70.69 8.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.204 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.118 -179.14 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.844 0.354 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -73.8 163.95 27.28 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.41 -33.18 62.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.084 -176.924 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 93.49 -53.71 2.39 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.004 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 25.1 m 62.64 -171.0 0.17 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.645 0.378 . . . . 0.0 110.595 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -144.73 -60.33 0.37 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -76.83 -53.83 7.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.926 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 21.9 t70 67.55 -70.87 0.11 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.461 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -91.09 -59.05 1.42 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.78 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 119.33 155.11 9.69 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.329 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -110.81 153.8 24.86 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.7 m -122.54 98.33 43.63 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-O 120.699 0.285 . . . . 0.0 110.722 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.06 -19.45 10.72 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.961 2.44 . . . . 0.0 112.184 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 98.7 t -122.83 122.15 65.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.58 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -88.43 89.18 7.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.972 0.415 . . . . 0.0 110.212 174.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -86.64 -26.36 24.4 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.763 177.04 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 36.7 mt 71.99 141.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.441 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -102.19 -55.41 2.48 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.236 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.5 m -161.06 107.12 1.26 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.925 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.425 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 45.0 Cg_endo -73.49 155.39 50.4 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 121.893 1.729 . . . . 0.0 110.845 174.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -129.58 157.4 42.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.903 0.382 . . . . 0.0 111.246 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.1 p -97.42 125.11 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.726 179.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.462 ' C ' ' H ' ' A' ' 151' ' ' TYR . 18.4 p-10 -94.43 96.62 9.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.344 0.593 . . . . 0.0 109.756 176.462 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.556 HD23 HD12 ' B' ' 504' ' ' LEU . 92.6 mt -71.48 25.27 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.462 ' H ' ' C ' ' A' ' 149' ' ' ASP . 3.3 t80 -96.57 -4.81 40.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 120.958 0.409 . . . . 0.0 109.994 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.65 -24.14 29.17 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.538 HD23 HD13 ' B' ' 504' ' ' LEU . 79.4 mt -62.63 135.52 57.42 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.231 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -74.98 163.26 27.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.405 177.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.91 -35.73 41.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.49 -44.89 95.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.767 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.44 HG22 ' HA ' ' B' ' 496' ' ' ILE . 8.4 m -69.65 -42.41 74.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.085 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.66 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.8 mt -61.25 -43.46 98.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.394 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -66.17 -34.86 78.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.74 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.663 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 34.7 ttm180 -68.16 -45.75 72.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.14 -178.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.523 ' HH ' HD13 ' A' ' 189' ' ' ILE . 48.4 t80 -52.89 -51.6 60.57 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.592 ' HZ2' ' HB3' ' A' ' 162' ' ' LYS . 10.2 mtpm? -59.95 -38.83 83.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.024 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -76.66 -44.97 31.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.242 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -70.04 -30.9 68.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.601 0.238 . . . . 0.0 111.002 -176.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.521 ' CZ ' HG23 ' B' ' 490' ' ' ILE . 62.6 m-85 -96.15 0.3 51.08 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.185 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.61 75.22 0.34 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.741 0.651 . . . . 0.0 111.846 178.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 89.2 mt -110.18 106.82 58.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.906 177.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_endo -65.26 125.7 15.01 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.347 2.031 . . . . 0.0 111.784 -178.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.575 HG21 HD13 ' A' ' 181' ' ' ILE . 20.3 p -141.95 148.07 38.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.98 -175.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -90.25 156.71 45.91 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.6 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.11 143.97 99.51 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.812 2.341 . . . . 0.0 112.656 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 110.6 31.41 2.99 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.756 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.9 mt -82.14 161.22 22.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.138 0.494 . . . . 0.0 111.06 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.694 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 16.3 t-20 -145.3 169.08 18.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 153' ' ' LEU . 22.3 tptm -50.66 -49.64 56.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.751 0.31 . . . . 0.0 110.4 176.138 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . 0.521 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -63.24 -40.43 97.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.119 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.694 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 62.3 mm-40 -62.57 -46.92 86.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.551 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.66 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 83.1 mt -61.21 -43.22 99.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.537 -178.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.427 HG21 ' CD1' ' A' ' 151' ' ' TYR . 57.1 t -60.37 -43.34 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.221 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.9 mt-10 -64.18 -41.75 96.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.906 0.384 . . . . 0.0 110.954 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.575 HD13 HG21 ' A' ' 169' ' ' THR . 81.3 mt -68.65 -50.88 51.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.822 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.486 HG11 HD12 ' A' ' 150' ' ' LEU . 77.9 t -58.44 -45.69 89.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.082 177.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . 0.44 ' O ' ' HG2' ' A' ' 187' ' ' LYS . . . -62.2 -42.05 99.72 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.733 -178.464 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.72 -45.55 93.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.83 0.348 . . . . 0.0 110.555 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -77.24 -29.92 54.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.704 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -63.07 -30.64 71.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.635 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.44 ' HG2' ' O ' ' A' ' 183' ' ' GLY . 72.8 mmtt -67.67 -12.51 60.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.659 178.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 17.0 m -133.87 59.62 1.73 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.067 0.46 . . . . 0.0 111.252 -176.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.778 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 67.8 mt -105.79 119.14 53.43 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.782 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.94 126.86 14.39 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.869 2.379 . . . . 0.0 111.17 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.518 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -142.15 131.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.103 0.478 . . . . 0.0 111.537 -175.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -109.36 125.44 52.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.938 177.268 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.514 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.6 tt0 -49.32 -62.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -172.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -55.89 -60.25 3.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -175.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.54 -42.01 64.02 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.115 0.483 . . . . 0.0 111.376 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 56.9 m -68.72 -41.05 79.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.188 -176.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 60.5 mt -66.11 -48.7 70.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.341 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.1 m -56.34 -46.49 79.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.755 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . 0.566 ' HA ' ' CE2' ' A' ' 202' ' ' TYR . 71.2 m -62.2 -48.85 78.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.246 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.575 ' CD1' HD21 ' B' ' 488' ' ' LEU . 82.6 t80 -60.38 -49.29 78.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.861 0.362 . . . . 0.0 110.633 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.461 HD12 ' HE2' ' B' ' 468' ' ' PHE . 61.9 mt -58.0 -52.17 61.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.769 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . 0.566 ' CE2' ' HA ' ' A' ' 199' ' ' CYS . 2.2 p90 -69.45 -35.3 75.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.915 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 44.8 m -64.93 -50.99 64.29 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.755 0.312 . . . . 0.0 110.629 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.422 HG23 ' CE1' ' A' ' 200' ' ' PHE . 47.0 t -69.58 -25.58 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.929 -176.783 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.444 ' HD3' HG22 ' A' ' 201' ' ' ILE . 33.6 mtp180 -73.32 -22.04 60.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.775 0.321 . . . . 0.0 111.338 175.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -97.47 -72.97 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.651 -0.249 . . . . 0.0 110.543 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.618 ' HB2' ' HE3' ' A' ' 210' ' ' LYS . 9.9 m-20 -140.29 124.99 18.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.81 90.32 8.36 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.55 -175.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . 0.537 ' OD1' ' HA ' ' B' ' 497' ' ' SER . 10.4 t30 72.37 114.99 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 123.819 0.699 . . . . 0.0 111.873 175.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.618 ' HE3' ' HB2' ' A' ' 207' ' ' ASP . 44.4 mttp -112.51 18.99 17.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.122 -177.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 60.1 p -73.97 -53.83 9.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 0.0 111.351 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.55 19.81 19.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.276 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 52.9 tp -61.65 -46.71 88.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 58.1 mttp 63.8 -178.66 0.16 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.255 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -134.69 173.58 11.52 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.192 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -76.72 133.33 39.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.306 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 13.9 m -78.65 -18.76 53.96 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.706 -178.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . 0.417 ' C ' ' H ' ' A' ' 220' ' ' HIS . . . 113.32 12.56 11.79 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.654 176.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 45.3 t 74.53 -14.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 123.245 0.618 . . . . 0.0 111.18 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . 0.417 ' H ' ' C ' ' A' ' 218' ' ' GLY . 16.8 t60 . . . . . 0 C--O 1.246 0.891 0 CA-C-O 118.619 -0.705 . . . . 0.0 110.016 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 111.66 0.244 . . . . 0.0 111.66 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -104.79 -25.01 12.83 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.744 0.307 . . . . 0.0 111.16 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -113.39 106.0 14.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.29 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 5.3 p -79.25 133.97 36.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.325 178.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -163.9 99.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.22 0.533 . . . . 0.0 111.222 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . 0.61 ' HD1' HG12 ' B' ' 461' ' ' VAL . 14.1 t-80 -165.38 148.28 7.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -74.65 65.85 2.09 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.92 -178.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . 0.61 HG12 ' HD1' ' B' ' 459' ' ' HIS . 22.6 m -123.64 165.12 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.578 0.228 . . . . 0.0 110.586 179.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 154.01 -38.2 0.69 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.108 -178.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 11.4 t -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.692 0.282 . . . . 0.0 110.722 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 32.0 mp0 -64.95 -48.08 75.36 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 3.6 m -63.19 -35.92 81.9 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.863 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 59.5 tp -60.41 -49.13 78.79 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.413 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.541 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.0 t80 -53.43 -57.68 9.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.42 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.461 ' HE2' HD12 ' A' ' 201' ' ' ILE . 54.5 m-85 -62.52 -33.6 75.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.508 -175.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.83 -44.76 84.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.231 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -67.73 -32.45 73.07 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.22 176.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.541 HG23 ' O ' ' B' ' 467' ' ' PHE . 76.2 t -59.85 -50.65 79.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.002 0.429 . . . . 0.0 109.935 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . 0.425 ' HG3' ' CE1' ' B' ' 481' ' ' TYR . 4.7 mtt-85 -56.28 -49.61 73.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.591 175.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -65.44 -41.38 93.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.049 -175.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -81.64 -40.7 22.52 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -68.39 -39.08 81.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.99 -178.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 71.03 -47.56 0.66 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.72 0.637 . . . . 0.0 111.884 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 27.3 t -72.92 130.54 40.62 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.98 0.419 . . . . 0.0 110.535 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.0 69.79 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.814 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -75.04 -34.28 61.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.53 -42.49 74.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 177.321 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.486 ' HH ' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.73 -40.49 96.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.066 175.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.715 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 30.2 tt0 -65.09 -38.16 89.84 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.87 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 13.9 t-20 -55.35 -47.6 75.51 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.967 174.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.518 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 85.8 t80 -53.6 -44.39 69.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.937 176.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.518 ' HB3' HG21 ' A' ' 191' ' ' VAL . 83.1 mt -69.98 -28.96 65.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.383 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.778 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 21.6 mmt85 -63.2 -49.28 74.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.512 0.673 . . . . 0.0 109.335 174.549 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.6 m -57.8 -35.76 71.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.216 176.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.575 HD21 ' CD1' ' A' ' 200' ' ' PHE . 24.8 mt -65.79 -54.45 26.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.309 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.6 m -58.64 -42.53 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.92 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.521 HG23 ' CZ ' ' A' ' 165' ' ' PHE . 20.8 pt -70.6 -31.32 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.881 -0.728 . . . . 0.0 111.161 179.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.22 -37.54 75.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.588 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.81 -30.44 71.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.265 0.555 . . . . 0.0 110.075 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.56 1.02 50.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.327 175.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 56.52 36.94 28.37 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.185 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.663 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.8 t -78.6 -46.24 24.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.408 174.258 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.44 ' HA ' HG22 ' A' ' 157' ' ' THR . 39.8 pt -102.9 141.67 18.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.721 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.537 ' HA ' ' OD1' ' A' ' 209' ' ' ASN . 8.0 m -81.76 179.21 7.92 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.558 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.571 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.4 ttm180 -60.21 -57.87 10.97 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.823 -0.172 . . . . 0.0 110.629 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.96 70.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.018 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.533 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 19.8 mm-40 -61.14 -49.97 75.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.521 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.495 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 61.5 tp -59.35 -45.74 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.879 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.571 HG23 ' O ' ' B' ' 498' ' ' ARG . 57.6 t -61.06 -40.7 86.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.186 -178.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -82.84 -22.41 34.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 150' ' ' LEU . 11.5 tp -67.31 -49.88 62.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.525 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.542 HG22 ' HB2' ' B' ' 508' ' ' PHE . 9.8 p -86.18 13.05 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.55 -176.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.527 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 22.8 t -57.19 -45.07 99.96 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' B' ' 506' ' ' SER . 11.7 Cg_endo -59.24 -17.95 42.12 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.287 1.991 . . . . 0.0 113.009 174.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.542 ' HB2' HG22 ' B' ' 505' ' ' VAL . 27.4 m-85 -105.71 149.12 26.69 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . . . . . . . . . 71.9 mt 68.56 -17.73 0.18 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 177.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . 0.448 ' H ' ' C ' ' B' ' 508' ' ' PHE . . . -65.89 -15.03 61.89 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.501 -0.381 . . . . 0.0 113.295 -176.411 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.409 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.8 mptp? -85.09 -10.39 56.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.109 0.481 . . . . 0.0 109.779 177.161 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -123.2 92.96 48.61 Favored Pre-proline 0 C--O 1.235 0.334 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.95 -175.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.05 -53.53 6.99 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.316 2.677 . . . . 0.0 113.564 -174.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -57.91 -37.42 74.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 111.948 -176.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 15.6 tp -79.48 -43.35 23.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.575 -171.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.457 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 0.6 OUTLIER -70.88 -28.41 64.53 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.141 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -67.73 -42.99 81.01 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -53.32 -48.58 68.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.495 ' HZ ' ' HG ' ' B' ' 501' ' ' LEU . 43.0 t80 -55.68 -52.41 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.137 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 58.2 mttp -59.76 -40.39 88.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.94 0.4 . . . . 0.0 111.076 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -69.66 -32.78 71.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.534 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . 0.409 ' CZ ' ' HG3' ' A' ' 205' ' ' ARG . 54.5 t80 -82.41 -31.91 29.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.736 0.779 . . . . 0.0 108.972 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.548 HD23 HG21 ' B' ' 502' ' ' VAL . 15.4 tp -81.76 -10.18 59.43 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.904 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.74 39.24 96.43 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.324 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -73.21 111.36 8.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.907 0.384 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 5.9 mtpt -124.69 8.82 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . 0.547 ' OE2' ' HD2' ' B' ' 498' ' ' ARG . 1.8 mp0 -84.91 16.43 3.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.761 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.7 -0.667 . . . . 0.0 110.309 179.652 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 120.674 0.273 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -150.04 -175.25 4.98 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.85 -42.54 6.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.08 0.467 . . . . 0.0 110.483 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.22 140.58 10.11 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.161 -179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.8 m -90.46 -2.38 57.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.392 0.615 . . . . 0.0 110.047 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.21 88.14 7.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.234 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -80.63 -65.45 1.01 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.211 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -96.26 -60.58 1.59 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.509 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -167.55 106.11 0.25 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.612 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -109.29 148.26 17.02 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.863 -0.684 . . . . 0.0 111.941 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.69 -3.11 55.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.701 0.286 . . . . 0.0 110.506 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 62.1 p 46.9 78.68 0.38 Allowed Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.828 -176.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.02 132.59 8.53 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.9 2.4 . . . . 0.0 111.46 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 47.3 t 61.43 87.42 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.367 0.603 . . . . 0.0 111.251 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -72.1 107.74 4.94 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 174.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.92 110.64 18.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.822 -174.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -149.2 112.29 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.754 -177.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -83.34 -52.74 6.29 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.8 m -151.79 97.35 3.07 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.505 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.525 ' HD2' ' HB1' ' B' ' 480' ' ' ALA . 52.6 Cg_exo -56.55 151.12 47.99 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.761 2.307 . . . . 0.0 112.385 178.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -104.84 142.24 35.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.371 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.97 106.22 19.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.412 0.625 . . . . 0.0 110.316 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -65.56 114.04 4.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.93 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 77.8 mt -100.1 -0.11 39.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.243 0.544 . . . . 0.0 110.369 179.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -75.3 -20.84 58.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.183 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.424 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 3.0 pt20 -70.29 -25.97 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.457 178.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.431 HD23 HD22 ' B' ' 504' ' ' LEU . 59.2 mt -68.29 161.29 27.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.327 0.584 . . . . 0.0 111.29 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.39 158.11 30.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.251 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 51.7 t -59.13 -44.77 92.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.159 0.504 . . . . 0.0 109.658 177.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -62.09 -35.28 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.082 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 41.4 m -67.36 -45.82 75.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.842 0.353 . . . . 0.0 110.824 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.98 -40.17 90.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.198 0.523 . . . . 0.0 110.802 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.495 ' O ' ' HG2' ' A' ' 163' ' ' ARG . 94.5 mtt180 -67.03 -37.24 83.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.347 175.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.516 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.8 ttm180 -61.46 -45.0 96.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.079 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.552 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 75.6 t80 -53.33 -50.28 65.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.091 173.663 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.478 ' HZ1' ' HB ' ' A' ' 181' ' ' ILE . 47.5 mttp -58.64 -45.49 89.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.144 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 159' ' ' ARG . 30.8 mmm180 -72.56 -39.29 67.56 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.407 -175.462 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -71.94 -33.72 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 111.344 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -93.29 3.11 56.18 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.421 178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt 61.56 48.95 5.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.764 173.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.482 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 85.7 mt -92.55 134.09 28.51 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.134 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 14.6 Cg_exo -69.39 127.32 14.71 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.032 2.488 . . . . 0.0 111.808 176.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.553 ' HB ' HD11 ' A' ' 173' ' ' LEU . 16.6 p -115.76 132.03 56.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.056 0.455 . . . . 0.0 111.352 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -85.64 154.71 59.1 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.244 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.49 137.67 56.22 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.736 2.291 . . . . 0.0 111.743 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 100.69 39.85 3.07 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.736 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.553 HD11 ' HB ' ' A' ' 169' ' ' THR . 85.8 mt -73.94 142.92 45.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.418 0.628 . . . . 0.0 111.634 -177.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.45 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 11.1 t-20 -136.06 159.93 40.2 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.588 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.64 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.3 tptm -48.16 -54.31 13.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.289 0.368 . . . . 0.0 111.425 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . 0.471 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -61.1 -37.47 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.113 -178.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.409 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.1 mm100 -63.92 -40.96 97.7 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.377 0.608 . . . . 0.0 110.068 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.47 ' O ' HG23 ' A' ' 182' ' ' VAL . 87.9 mt -61.16 -49.77 75.89 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 177.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.64 HG23 ' O ' ' A' ' 175' ' ' LYS . 19.0 t -56.92 -47.06 83.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 O-C-N 123.777 0.673 . . . . 0.0 111.034 -178.424 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.471 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.0 mt-10 -58.7 -50.11 75.1 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.478 ' HB ' ' HZ1' ' A' ' 162' ' ' LYS . 67.3 mt -61.96 -39.0 82.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.858 0.361 . . . . 0.0 110.761 179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.586 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 71.9 t -64.02 -49.56 81.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.707 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.43 -33.71 85.61 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.473 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.03 -49.12 79.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.824 0.345 . . . . 0.0 110.298 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -83.57 -23.53 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.056 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.586 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.3 t80 -58.54 -40.67 83.61 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.88 0.472 . . . . 0.0 110.67 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.78 0.23 27.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.87 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -107.25 13.77 26.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.809 0.338 . . . . 0.0 111.027 -179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.68 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 74.7 mt -90.89 116.61 66.79 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.899 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.4 112.09 3.45 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.657 2.238 . . . . 0.0 111.345 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.0 p -120.11 137.2 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -108.23 136.38 47.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.178 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -58.25 -61.87 2.25 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -55.98 -55.81 28.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.624 -176.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.09 -49.24 69.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.9 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 38.9 m -69.32 -44.94 70.68 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.415 HD12 ' HH ' ' B' ' 481' ' ' TYR . 56.4 mt -60.12 -41.52 92.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.92 0.39 . . . . 0.0 110.129 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 54.4 m -58.93 -47.55 84.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.86 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.87 -45.97 92.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.563 ' CD1' HD23 ' B' ' 488' ' ' LEU . 65.6 t80 -61.43 -58.86 6.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.312 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.474 HD12 ' HE2' ' B' ' 468' ' ' PHE . 67.8 mt -56.38 -43.41 77.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.025 0.441 . . . . 0.0 110.707 -175.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -62.52 -46.38 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.179 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 21.3 m -68.71 -39.94 80.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.678 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.639 ' HA ' ' HG2' ' A' ' 208' ' ' LYS . 21.6 t -75.69 -25.78 17.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.867 0.365 . . . . 0.0 111.099 -176.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 205' ' ' ARG . 13.3 mtp180 -76.21 -10.43 59.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 110.553 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -121.74 -146.95 0.38 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.466 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -67.01 114.33 5.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.789 0.804 . . . . 0.0 109.316 171.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.639 ' HG2' ' HA ' ' A' ' 204' ' ' VAL . 86.6 mttt -72.61 3.02 5.42 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.152 -1.385 . . . . 0.0 112.187 -172.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -168.25 -72.81 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.377 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 25.8 pttm 179.64 -19.81 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.259 0.223 . . . . 0.0 110.827 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 57.0 m 68.49 104.06 0.05 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.426 0.632 . . . . 0.0 110.878 -177.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.97 84.51 6.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.333 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 79.4 mt -109.92 -56.08 2.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.036 0.446 . . . . 0.0 110.107 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -137.46 174.75 10.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.782 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -100.38 -51.27 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.297 0.57 . . . . 0.0 109.825 176.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -87.61 88.72 7.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.495 177.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 9.1 p -92.47 -80.56 0.36 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.619 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -148.34 96.43 0.17 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 34.4 m -98.55 158.71 3.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 39.2 t-80 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.535 -0.745 . . . . 0.0 109.904 -179.113 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 5.8 p . . . . . 0 N--CA 1.475 0.816 0 CA-C-O 121.296 0.569 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -89.59 130.35 35.91 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.01 0.433 . . . . 0.0 110.689 -176.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -132.44 96.32 3.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.277 175.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 25.5 p -133.8 130.75 38.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.2 137.8 44.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 174.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -81.15 155.1 26.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.579 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 120.46 172.21 14.66 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.307 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.37 -19.4 9.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.821 0.343 . . . . 0.0 110.71 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 141.55 -41.05 1.27 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.855 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.1 t -69.89 -27.04 64.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.863 0.364 . . . . 0.0 111.016 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.406 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 7.2 mp0 -66.68 -52.66 42.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 178.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.0 t -63.01 -34.06 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.885 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.491 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 42.2 tp -59.24 -50.85 72.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.829 175.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 68.5 t80 -52.91 -52.45 57.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.72 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.474 ' HE2' HD12 ' A' ' 201' ' ' ILE . 35.2 m-85 -62.87 -36.51 83.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -176.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.27 -39.01 86.0 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . 0.491 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 64.0 mttm -59.85 -49.65 76.86 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.397 174.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.583 HG13 HD21 ' B' ' 509' ' ' LEU . 64.2 t -55.95 -48.0 79.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 121.334 0.587 . . . . 0.0 110.302 177.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -59.59 -33.67 71.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.05 -177.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -86.26 -50.18 7.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.415 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -67.76 -32.4 72.96 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.86 -21.04 66.03 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 64.93 0.43 1.2 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.402 ' HB3' ' HB1' ' B' ' 480' ' ' ALA . 40.4 t -134.82 129.98 35.35 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.915 0.388 . . . . 0.0 110.86 -177.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.03 -39.23 90.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.364 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.12 -31.51 72.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.96 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.525 ' HB1' ' HD2' ' A' ' 146' ' ' PRO . . . -64.78 -47.19 79.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.424 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 75.8 t80 -65.75 -35.9 82.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.832 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.29 -38.03 89.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.442 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.44 ' HA ' ' HB2' ' B' ' 486' ' ' ARG . 7.1 t30 -72.78 -30.99 64.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.12 0.486 . . . . 0.0 110.323 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.439 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 68.4 t80 -60.48 -50.48 73.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.314 0.578 . . . . 0.0 109.471 171.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 75.5 mt -64.83 -29.1 70.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.457 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.68 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 2.4 tpp85 -60.19 -49.11 78.9 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.861 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 37.9 m -63.04 -31.13 72.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.57 175.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.563 HD23 ' CD1' ' A' ' 200' ' ' PHE . 33.6 mt -68.88 -45.19 71.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.585 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.441 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.2 m -65.83 -40.73 88.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.264 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.553 HD13 ' HE1' ' A' ' 186' ' ' PHE . 39.9 pt -67.84 -32.44 56.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 119.689 -0.804 . . . . 0.0 110.487 177.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -63.93 -43.03 97.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.251 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -63.5 -29.64 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.186 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 79.3 mt-30 -95.17 17.84 13.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.799 -177.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 59.95 27.15 16.48 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.407 0.683 . . . . 0.0 112.056 177.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.516 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 88.0 t -78.21 -41.56 26.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.303 0.573 . . . . 0.0 109.606 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.517 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 48.1 pt -124.68 154.17 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.819 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.3 t -102.94 -169.4 1.65 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.421 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.51 ' O ' HG22 ' B' ' 502' ' ' VAL . 19.5 ttm180 -55.54 -55.48 31.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.442 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -54.01 -50.45 66.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.486 -176.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.517 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 2.4 mp0 -59.91 -46.31 89.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.118 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.423 HD22 HD21 ' B' ' 523' ' ' LEU . 65.2 tp -57.83 -44.7 86.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.918 0.39 . . . . 0.0 111.114 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.629 HG23 HD22 ' B' ' 523' ' ' LEU . 59.7 t -67.79 -36.39 75.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.424 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 26.5 mt-30 -77.27 -35.11 55.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.266 -177.048 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 91.1 mt -65.7 -37.71 87.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 0.0 111.503 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.7 p -87.11 6.7 2.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.967 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.6 t -59.01 -49.2 94.62 Favored Pre-proline 0 CA--C 1.542 0.638 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.741 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 36.8 Cg_exo -63.06 -6.38 9.51 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.228 1.952 . . . . 0.0 113.132 177.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.47 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 68.3 m-85 -108.4 -66.02 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.665 -178.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.583 HD21 HG13 ' B' ' 471' ' ' VAL . 82.4 mt -90.99 -13.15 33.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.72 -12.06 66.81 Favored Glycine 0 C--O 1.23 -0.109 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.077 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -80.15 -13.66 59.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.352 0.596 . . . . 0.0 109.8 176.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.76 89.47 47.84 Favored Pre-proline 0 N--CA 1.451 -0.416 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.809 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_exo -51.88 -35.94 61.68 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.319 2.679 . . . . 0.0 113.313 -177.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.18 -48.64 50.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.275 0.559 . . . . 0.0 110.408 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.499 HD22 HD23 ' B' ' 509' ' ' LEU . 18.0 tp -67.07 -38.8 86.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.475 0.655 . . . . 0.0 110.044 -178.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -67.29 -32.33 73.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.031 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.75 -40.46 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.821 176.721 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.406 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 9.7 t90 -58.65 -49.22 78.31 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.541 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 18.2 t80 -56.95 -46.08 82.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.909 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.66 -37.05 85.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.172 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -65.34 -38.91 91.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.438 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -82.42 -35.02 28.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.562 0.696 . . . . 0.0 109.745 -175.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.629 HD22 HG23 ' B' ' 502' ' ' VAL . 11.8 tp -85.31 -24.9 27.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.367 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 88.87 26.99 25.22 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.638 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -86.92 124.22 32.89 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.844 0.354 . . . . 0.0 110.272 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -119.59 151.19 39.06 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.64 177.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.78 57.71 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.029 0.442 . . . . 0.0 110.792 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.822 -0.609 . . . . 0.0 109.966 -179.748 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 27.6 t . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.496 0.189 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -66.72 -60.13 2.96 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.728 0.299 . . . . 0.0 110.303 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -134.91 149.65 50.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.275 176.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -136.91 84.25 0.25 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.292 -179.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 p -129.23 14.52 6.17 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.064 0.459 . . . . 0.0 110.629 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.24 167.95 18.33 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.632 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.2 t70 73.78 -73.03 0.1 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.979 0.799 . . . . 0.0 111.119 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -149.27 111.03 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.626 0.25 . . . . 0.0 110.895 178.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -75.37 -46.95 13.67 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.293 175.095 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 100.3 48.68 1.53 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.474 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -82.04 -54.14 5.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.714 0.292 . . . . 0.0 111.113 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.0 m -76.88 119.13 76.19 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.177 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.95 161.02 21.04 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.769 2.313 . . . . 0.0 112.136 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . 0.511 HG12 ' HB3' ' B' ' 511' ' ' LYS . 39.8 t -107.6 90.04 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 120.833 0.349 . . . . 0.0 110.526 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -160.69 88.53 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.405 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 3.5 t70 63.59 114.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 O-C-N 124.117 0.886 . . . . 0.0 112.35 174.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.543 ' O ' ' HD2' ' B' ' 476' ' ' ARG . 1.1 pp -118.11 144.41 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.587 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.4 t70 -102.4 -46.25 4.84 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.31 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.2 m -154.32 95.35 2.74 Favored Pre-proline 0 C--O 1.234 0.278 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.576 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.504 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 7.4 Cg_exo -70.81 147.23 55.65 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.305 2.003 . . . . 0.0 111.064 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -107.92 152.44 24.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.892 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 5.5 p -99.6 121.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.148 0.499 . . . . 0.0 110.348 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -77.57 121.09 23.43 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 85.3 mt -109.38 8.27 25.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.153 0.501 . . . . 0.0 110.616 -179.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -90.8 -25.94 19.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.446 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.472 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 25.6 pt20 -63.71 -26.42 68.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.458 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.707 HD21 ' HB3' ' B' ' 500' ' ' GLU . 63.7 mt -66.31 161.8 21.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.404 -177.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -79.15 154.63 29.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.606 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.561 HG11 ' CD1' ' A' ' 178' ' ' LEU . 37.0 t -61.31 -39.25 82.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.808 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.6 p30 -64.66 -30.01 71.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.541 0.21 . . . . 0.0 110.479 179.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 17.2 m -68.9 -45.96 69.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.127 0.489 . . . . 0.0 110.395 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.4 mt -65.28 -41.3 94.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.713 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . 0.417 ' O ' ' HG3' ' A' ' 163' ' ' ARG . 82.8 mtp180 -66.35 -33.36 75.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.455 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.478 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 18.3 ttm180 -65.41 -44.71 86.57 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.601 ' HH ' ' HA ' ' A' ' 186' ' ' PHE . 68.0 t80 -55.74 -50.16 71.13 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.552 174.203 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.873 ' HZ3' HG21 ' A' ' 181' ' ' ILE . 21.3 mtpp -64.66 -38.71 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.442 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 81.8 mtp180 -76.9 -34.77 57.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.764 0.316 . . . . 0.0 110.738 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -69.85 -47.68 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -85.06 -1.89 57.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.443 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm 58.49 81.36 0.16 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.722 0.639 . . . . 0.0 111.129 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.541 ' HB2' ' HZ1' ' A' ' 162' ' ' LYS . 82.4 mt -116.19 100.53 53.56 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.626 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.47 141.72 89.86 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.263 2.642 . . . . 0.0 111.978 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.404 ' CG2' HD13 ' A' ' 173' ' ' LEU . 4.1 t -167.98 146.42 4.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.712 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -74.59 157.81 85.69 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.13 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.34 171.43 12.85 Favored 'Trans proline' 0 C--O 1.234 0.307 0 C-N-CA 122.602 2.201 . . . . 0.0 112.08 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 81.69 33.58 27.21 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.793 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.404 HD13 ' CG2' ' A' ' 169' ' ' THR . 83.5 mt -82.85 147.03 28.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 111.29 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.09 -175.56 3.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.726 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.66 ' O ' HG22 ' A' ' 179' ' ' VAL . 19.6 tptm -58.87 -58.37 8.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.233 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.28 69.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 0.0 111.359 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -59.96 -50.45 73.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.306 0.574 . . . . 0.0 110.739 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.561 ' CD1' HG11 ' A' ' 155' ' ' VAL . 68.1 mt -60.51 -43.65 96.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.66 HG22 ' O ' ' A' ' 175' ' ' LYS . 21.9 t -57.85 -45.76 87.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.972 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.62 -46.6 89.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.08 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.873 HG21 ' HZ3' ' A' ' 162' ' ' LYS . 63.1 mt -65.4 -45.72 92.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.3 t -60.74 -49.54 84.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.787 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.13 -38.56 95.8 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.169 -0.538 . . . . 0.0 112.235 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.21 -51.55 69.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.575 0.226 . . . . 0.0 110.772 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -80.83 -24.5 38.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.744 0.307 . . . . 0.0 111.183 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.601 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 15.5 t80 -61.48 -44.64 96.74 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.452 -178.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -82.37 22.6 0.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 111.416 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -126.99 22.58 6.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.169 0.509 . . . . 0.0 110.143 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.709 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.9 mt -97.72 118.83 63.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.183 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 7.1 Cg_exo -72.93 113.48 3.78 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 122.969 2.446 . . . . 0.0 110.807 174.305 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 7.7 p -119.49 156.43 21.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.877 0.37 . . . . 0.0 111.18 -172.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . 0.511 ' O ' ' HB ' ' A' ' 196' ' ' THR . 92.3 m-20 -107.71 147.84 30.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.093 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.639 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.7 tt0 -72.28 -66.4 0.65 Allowed 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.597 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -73.43 -45.25 55.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.495 -172.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.76 -42.74 99.82 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.158 -176.192 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 196' ' ' THR . . . . . 0.511 ' HB ' ' O ' ' A' ' 192' ' ' ASN . 99.4 m -72.68 -38.03 67.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.359 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 37.6 mt -57.69 -51.01 71.28 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 19.5 m -58.49 -44.73 89.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.623 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.2 t -55.06 -54.72 39.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.361 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.597 ' CD1' HD21 ' B' ' 488' ' ' LEU . 70.0 t80 -57.79 -48.65 79.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.616 -177.569 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 197' ' ' LEU . 91.7 mt -54.89 -51.7 50.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.944 -178.025 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -67.42 -30.73 70.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.741 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.8 m -63.64 -52.03 62.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 0.0 110.931 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.451 HG22 ' O ' ' A' ' 200' ' ' PHE . 13.7 t -68.63 -27.67 37.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.166 0.508 . . . . 0.0 110.264 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 68.8 mtp180 -87.5 16.1 5.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.362 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . 0.428 HD21 ' HA ' ' A' ' 206' ' ' ASN . 0.5 OUTLIER -120.64 -82.69 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.582 175.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.565 ' CG ' ' H ' ' A' ' 208' ' ' LYS . 5.2 p-10 -142.45 -94.88 0.12 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.763 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.565 ' H ' ' CG ' ' A' ' 207' ' ' ASP . 70.9 mmtt 59.92 80.06 0.21 Allowed 'General case' 0 C--N 1.328 -0.332 0 O-C-N 123.57 0.544 . . . . 0.0 110.859 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 63.7 t30 75.35 168.94 0.28 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.399 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 59.6 tttp 72.92 116.4 0.05 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.295 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 29.8 m -69.73 -30.51 68.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.568 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . 0.424 ' O ' ' HB2' ' A' ' 213' ' ' LEU . 37.9 t70 61.56 87.35 0.1 Allowed 'General case' 0 C--O 1.233 0.185 0 O-C-N 123.849 0.718 . . . . 0.0 110.083 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . 0.424 ' HB2' ' O ' ' A' ' 212' ' ' ASP . 10.6 mp 69.36 106.16 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.834 -1.076 . . . . 0.0 111.117 -175.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 25.4 ttmm -83.41 -29.2 28.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.907 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -147.3 144.41 28.78 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.853 178.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -68.06 -39.4 82.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.804 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 6.6 t -159.31 149.63 19.22 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -166.25 59.08 0.24 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.084 178.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 7.8 p -65.48 126.46 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.135 0.493 . . . . 0.0 110.812 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 29.2 m80 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.602 -0.713 . . . . 0.0 110.353 178.528 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 454' ' ' SER . . . . . 0.402 ' C ' HD21 ' B' ' 455' ' ' ASN . 35.7 m . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 120.641 0.258 . . . . 0.0 110.722 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . 0.402 HD21 ' C ' ' B' ' 454' ' ' SER . 0.8 OUTLIER -130.19 129.0 42.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.711 0.291 . . . . 0.0 110.798 -178.826 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -154.42 141.52 19.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.877 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 8.1 t -95.95 85.29 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.969 0.414 . . . . 0.0 110.711 -178.743 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt 56.52 -85.47 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.212 1.005 . . . . 0.0 112.763 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 32.4 m170 65.59 88.76 0.1 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.073 0.549 . . . . 0.0 111.043 -173.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -107.38 -111.45 3.55 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.28 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 5.4 p -100.41 160.27 3.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 133.12 -6.4 5.06 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.5 t -82.97 -1.63 52.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.52 . . . . 0.0 110.825 -178.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -58.81 -36.83 75.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.906 174.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.3 t -60.01 -39.49 85.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.839 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.405 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 59.9 tp -60.56 -49.07 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.065 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -53.73 -54.92 31.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.777 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.43 ' HE2' HD12 ' A' ' 201' ' ' ILE . 38.6 m-85 -65.32 -33.56 76.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.73 -175.334 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.53 -42.76 98.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.982 0.42 . . . . 0.0 110.133 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . 0.405 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 65.8 mttm -58.42 -51.29 70.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.27 174.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . 93.8 t -57.07 -44.35 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.95 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -58.03 -37.44 74.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.382 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -86.86 -38.42 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.979 0.419 . . . . 0.0 111.351 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.642 ' HB3' ' CE2' ' B' ' 512' ' ' PHE . . . -65.88 -49.19 68.98 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 -174.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.75 -31.14 72.22 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.216 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . 0.543 ' HD2' ' O ' ' A' ' 143' ' ' ILE . 34.9 ttm180 69.32 -59.47 0.48 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.951 0.782 . . . . 0.0 111.986 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.587 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 14.1 t -64.42 130.8 45.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -178.04 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.43 78.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.326 176.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -69.63 -39.27 77.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.504 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -66.62 -44.39 82.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.156 177.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.411 ' CE2' HD12 ' B' ' 485' ' ' LEU . 84.5 t80 -64.91 -41.14 95.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.931 0.396 . . . . 0.0 110.045 177.506 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.588 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.2 tt0 -60.07 -43.42 95.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.547 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.6 -45.26 89.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.811 178.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.481 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 63.3 t80 -54.33 -48.78 70.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.359 174.846 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.411 HD12 ' CE2' ' B' ' 481' ' ' TYR . 82.9 mt -63.88 -34.7 78.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.943 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.709 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 18.9 mtt85 -66.23 -36.98 84.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.744 0.307 . . . . 0.0 110.339 176.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.37 -34.27 75.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.488 . . . . 0.0 109.752 174.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.597 HD21 ' CD1' ' A' ' 200' ' ' PHE . 39.7 mt -68.23 -45.14 74.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.453 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.448 HG23 ' HA ' ' B' ' 486' ' ' ARG . 14.9 m -67.14 -42.5 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.694 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.466 HD12 ' CE1' ' A' ' 186' ' ' PHE . 28.0 pt -68.54 -31.18 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.515 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.2 -43.91 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.146 173.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.3 -37.33 85.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.199 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.8 16.0 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.772 -176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 67.35 10.95 8.11 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 122.608 0.363 . . . . 0.0 111.665 177.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.495 HG13 ' HA ' ' A' ' 161' ' ' TYR . 77.2 t -70.91 -42.46 77.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 111.61 -174.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 45.3 pt -117.56 151.25 19.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.732 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.689 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 13.5 m -75.49 160.03 30.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.423 ' O ' ' HB3' ' B' ' 501' ' ' LEU . 16.5 ttp180 -67.48 -36.54 81.32 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.802 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -64.54 -43.95 92.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.349 . . . . 0.0 110.333 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.707 ' HB3' HD21 ' A' ' 153' ' ' LEU . 9.3 mm-40 -55.86 -38.8 70.6 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.656 176.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.423 ' HB3' ' O ' ' B' ' 498' ' ' ARG . 60.2 tp -61.58 -49.78 75.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.471 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.573 HG11 ' CZ ' ' B' ' 516' ' ' PHE . 0.4 OUTLIER -59.21 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.176 0.512 . . . . 0.0 109.791 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . 0.472 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 44.9 mt-30 -66.51 -42.0 87.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.806 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.589 HD23 HD12 ' A' ' 153' ' ' LEU . 50.2 mt -61.02 -41.97 97.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.878 0.37 . . . . 0.0 111.544 -178.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . 0.697 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -87.09 4.06 4.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.016 -178.324 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.505 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 33.7 t -58.83 -48.39 96.91 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.944 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.505 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 52.7 Cg_exo -56.73 -20.66 36.04 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.808 1.672 . . . . 0.0 112.734 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.416 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 72.8 m-85 -96.66 -60.59 1.57 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.182 -175.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.697 ' HG ' HG22 ' B' ' 505' ' ' VAL . 55.6 mt -84.61 -19.84 32.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.077 -175.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.16 -8.92 52.66 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.316 -0.468 . . . . 0.0 112.344 -179.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.511 ' HB3' HG12 ' A' ' 140' ' ' VAL . 55.6 mttm -73.31 -21.58 60.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 174.264 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.642 ' CE2' ' HB3' ' B' ' 474' ' ' ALA . 31.8 m-85 -128.0 101.96 22.31 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.86 -49.55 16.57 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.124 2.549 . . . . 0.0 112.704 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -56.9 -43.9 81.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 0.0 111.336 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.58 -44.58 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.998 -174.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.573 ' CZ ' HG11 ' B' ' 502' ' ' VAL . 7.9 t80 -70.34 -29.94 66.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.429 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -67.27 -42.26 84.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.842 176.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -54.96 -48.52 73.1 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.484 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.492 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 29.5 t80 -56.45 -51.38 68.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.967 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.437 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 99.2 mttt -59.53 -34.98 73.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.855 0.359 . . . . 0.0 110.917 178.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -66.69 -35.33 79.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.013 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -78.91 -34.09 44.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.22 0.533 . . . . 0.0 110.367 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.439 ' CD2' HG22 ' B' ' 502' ' ' VAL . 11.0 mp -80.7 -16.26 54.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.401 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 69.85 37.11 75.0 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.287 -175.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -86.41 86.7 7.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.111 0.481 . . . . 0.0 110.446 -176.361 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.32 114.69 22.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.258 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -90.59 5.52 47.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.406 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.251 1.169 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.516 179.849 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.9 m . . . . . 0 N--CA 1.475 0.791 0 CA-C-O 120.556 0.217 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 49.7 t30 74.48 -65.11 0.36 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.613 0.765 . . . . 0.0 111.275 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -92.07 111.05 22.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.632 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -114.2 -176.2 19.0 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.914 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 m -89.82 127.32 35.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.945 0.402 . . . . 0.0 111.175 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -87.09 -56.79 3.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.273 0.558 . . . . 0.0 109.558 176.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -76.77 -43.88 35.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.874 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 25.0 t70 57.96 67.88 0.9 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.396 177.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -104.3 48.91 0.96 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.505 -0.771 . . . . 0.0 113.312 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -103.47 -37.07 3.13 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.5 -0.857 . . . . 0.0 110.96 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -85.7 -31.59 22.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.06 -0.57 . . . . 0.0 110.509 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 24.0 t -134.72 127.36 18.45 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.694 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.86 174.17 13.29 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.551 2.168 . . . . 0.0 112.527 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.89 121.26 11.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.767 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -138.03 110.65 7.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.231 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' B' ' 477' ' ' SER . 18.4 t70 -91.52 -3.25 56.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 173.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . 0.434 ' HB ' ' HD3' ' A' ' 146' ' ' PRO . 10.5 mm 66.8 17.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.488 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 37.7 t70 61.32 13.4 4.9 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 113.879 -1.509 . . . . 0.0 110.632 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m 65.39 94.29 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.586 -176.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.515 ' HD2' ' HB3' ' B' ' 480' ' ' ALA . 31.6 Cg_exo -58.86 152.63 56.19 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.707 2.271 . . . . 0.0 111.756 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -123.53 135.65 54.13 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 -174.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . 0.492 HG13 HD22 ' B' ' 483' ' ' ASN . 4.1 p -96.23 124.77 49.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.315 -177.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . 0.527 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 50.9 m-20 -86.39 110.82 19.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.25 176.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . 0.414 HD11 HG13 ' A' ' 182' ' ' VAL . 65.8 mt -90.68 -3.84 57.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.423 0.63 . . . . 0.0 109.885 177.109 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -77.1 -11.16 59.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.36 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 29.7 pt20 -90.63 -9.38 47.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.291 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.404 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.8 mt -77.08 166.06 23.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.2 0.524 . . . . 0.0 111.649 -175.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . 0.433 HE21 ' HB2' ' A' ' 154' ' ' GLN . 17.2 mt-30 -71.97 154.84 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.343 176.068 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.94 -42.56 93.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.615 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.34 -31.55 71.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.364 -179.044 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.43 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 10.0 m -66.12 -42.39 89.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.264 0.554 . . . . 0.0 110.469 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . 0.518 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 75.7 mt -65.49 -41.62 93.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.249 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.66 -39.21 93.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.248 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 27.2 tpt180 -56.88 -52.89 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.477 177.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.586 ' HH ' HD11 ' A' ' 189' ' ' ILE . 58.1 t80 -52.34 -52.28 54.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.06 176.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.566 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 58.6 mtpt -65.37 -31.5 72.64 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.598 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.71 -47.85 20.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.605 0.24 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . 0.428 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 16.0 t-80 -70.09 -35.98 74.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.791 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.433 ' CE1' HG23 ' B' ' 490' ' ' ILE . 59.0 m-85 -88.86 6.38 39.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.626 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt 56.76 51.42 10.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.73 175.289 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 162' ' ' LYS . 90.7 mt -91.76 131.49 35.56 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.575 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 36.0 Cg_exo -59.84 150.16 79.25 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.936 2.424 . . . . 0.0 111.855 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.4 p -132.56 162.64 30.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.644 -177.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -119.83 151.76 52.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.921 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.22 137.57 79.71 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.428 2.086 . . . . 0.0 112.007 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 83.16 65.27 1.6 Allowed Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.744 -0.741 . . . . 0.0 111.829 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.81 141.32 32.39 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.409 0.623 . . . . 0.0 111.306 178.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.517 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 17.1 t-20 -137.48 166.6 23.47 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.076 -0.965 . . . . 0.0 108.671 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.604 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.8 tptm -50.3 -53.12 30.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.358 0.411 . . . . 0.0 110.699 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.79 -40.61 88.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.445 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . 0.4 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 24.6 mm-40 -60.05 -46.2 90.31 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.487 0.66 . . . . 0.0 110.257 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.518 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 77.2 mt -60.73 -51.13 70.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.171 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.604 HG23 ' O ' ' A' ' 175' ' ' LYS . 46.3 t -57.28 -43.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.275 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . 0.428 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 47.6 mt-10 -58.74 -55.57 33.4 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.283 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . 0.566 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 63.8 mt -63.22 -42.24 95.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.607 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.44 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 47.2 t -58.66 -49.73 81.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.231 177.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . 0.447 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -64.57 -37.24 94.15 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.131 -0.556 . . . . 0.0 112.247 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.1 t -56.67 -48.1 78.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.741 0.305 . . . . 0.0 110.651 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -83.58 -24.73 31.4 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.752 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.579 ' HA ' ' HH ' ' A' ' 161' ' ' TYR . 54.4 t80 -60.9 -34.28 74.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . 0.447 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 64.4 mttm -81.69 -1.03 45.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.896 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.4 t -130.96 45.63 2.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 110.285 -175.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.682 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 64.2 mt -103.16 115.1 64.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.677 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.36 110.1 1.51 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.349 2.033 . . . . 0.0 111.131 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.415 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.6 p -134.18 128.66 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.067 0.461 . . . . 0.0 111.165 -174.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -104.42 126.45 51.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.097 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.647 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 38.5 tt0 -49.69 -65.21 0.6 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -172.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -58.44 -50.04 75.14 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -60.45 -41.6 94.42 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.934 -179.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 66.8 m -66.78 -41.6 87.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 27.5 mt -58.31 -49.22 77.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.559 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -57.2 -47.24 81.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.04 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 78.2 m -58.46 -54.85 42.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.074 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.481 ' CG ' HD21 ' B' ' 488' ' ' LEU . 92.6 t80 -60.94 -47.09 88.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.225 -176.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.422 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 73.0 mt -57.58 -53.49 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.185 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -70.82 -22.66 62.31 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.287 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 72.3 m -67.57 -50.81 56.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.652 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.6 ' HA ' ' O ' ' A' ' 207' ' ' ASP . 37.4 t -73.73 -25.06 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 111.068 -177.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 12.2 mmm180 -61.96 -25.72 67.78 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.138 177.13 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -95.02 -56.69 2.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.738 0.304 . . . . 0.0 110.452 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . 0.6 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 8.8 t70 -153.22 -161.57 1.3 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.435 ' H ' ' CG ' ' A' ' 207' ' ' ASP . 10.1 mptt -113.65 15.4 18.86 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -179.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . 0.791 HD22 ' HG2' ' B' ' 494' ' ' GLU . 6.1 t30 63.73 50.1 2.77 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -113.89 134.25 54.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.901 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 1.3 m -90.88 91.56 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.634 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -101.35 -49.04 4.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.978 0.418 . . . . 0.0 110.264 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.45 112.15 15.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.471 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -145.19 114.25 6.97 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.712 -178.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 56.32 83.6 0.09 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.129 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -105.86 -53.42 2.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.601 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 19.0 m -80.43 95.22 6.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.916 0.389 . . . . 0.0 110.193 178.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -123.6 32.21 4.35 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.077 -0.582 . . . . 0.0 111.897 -177.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.51 -23.64 26.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.841 0.353 . . . . 0.0 110.877 -179.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 80.9 t60 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.472 -0.775 . . . . 0.0 109.745 177.472 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.791 0.329 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -85.08 -42.5 14.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.499 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . 64.08 101.06 0.03 OUTLIER 'General case' 0 C--O 1.235 0.302 0 O-C-N 123.931 0.769 . . . . 0.0 111.348 -177.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 2.5 p -69.36 138.66 53.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.9 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -132.59 105.14 7.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.487 -178.12 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 59.13 49.48 9.24 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.416 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 154.23 177.29 27.48 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.493 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 56.9 t -109.3 -49.06 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.854 0.359 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 162.92 -173.62 39.15 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.098 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.3 p -73.86 -12.69 60.75 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.12 -52.01 67.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.963 0.411 . . . . 0.0 109.958 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.1 m -62.26 -34.54 76.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.444 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.01 -48.81 78.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.349 177.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.543 ' O ' HG22 ' B' ' 471' ' ' VAL . 61.3 t80 -52.5 -55.72 20.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.834 176.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.526 ' CD1' HD23 ' A' ' 197' ' ' LEU . 79.2 m-85 -65.04 -32.78 74.67 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -174.396 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -63.19 -41.81 99.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.127 0.489 . . . . 0.0 109.897 174.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -68.36 -33.66 74.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.85 176.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.543 HG22 ' O ' ' B' ' 467' ' ' PHE . 97.2 t -61.47 -49.22 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 177.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -62.77 -35.15 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.151 0.5 . . . . 0.0 109.869 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -76.27 -23.85 54.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.467 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -88.42 -54.98 3.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.355 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.61 -44.35 96.53 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 68.46 -56.95 0.5 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.011 0.819 . . . . 0.0 112.588 173.964 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.48 ' HB2' ' O ' ' A' ' 142' ' ' ASP . 21.8 t -59.11 137.96 57.75 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.798 0.439 . . . . 0.0 110.802 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -60.32 -55.92 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.309 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.93 -32.82 72.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.515 ' HB3' ' HD2' ' A' ' 146' ' ' PRO . . . -68.77 -50.97 46.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.473 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.27 -37.43 85.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.992 0.425 . . . . 0.0 110.328 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.704 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 26.4 tt0 -67.21 -34.54 77.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.77 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . 0.492 HD22 HG13 ' A' ' 148' ' ' VAL . 20.7 t-20 -59.94 -43.4 94.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.434 175.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.1 -45.33 79.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.08 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.415 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.3 mt -66.51 -29.52 69.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.116 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.704 ' HG2' ' O ' ' B' ' 482' ' ' GLU . 17.6 mmt85 -60.46 -46.25 90.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 174.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.7 m -61.97 -34.94 77.06 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.667 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.481 HD21 ' CG ' ' A' ' 200' ' ' PHE . 38.8 mt -66.61 -49.37 66.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.525 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 9.7 m -64.71 -42.01 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.672 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.476 HD11 ' HE1' ' A' ' 186' ' ' PHE . 12.1 pt -69.91 -31.11 46.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.128 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . 0.49 ' HB2' HD13 ' B' ' 501' ' ' LEU . 91.2 t80 -65.44 -44.0 88.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.167 0.508 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.19 -35.52 79.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.653 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . 0.428 ' HB3' ' CE1' ' A' ' 164' ' ' HIS . 77.7 mt-30 -83.62 14.6 3.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.644 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . 0.791 ' HG2' HD22 ' A' ' 209' ' ' ASN . 34.7 mt-10 62.22 28.91 17.3 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.643 0.259 . . . . 0.0 111.149 176.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.41 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 69.1 t -87.46 -50.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.067 -178.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 46.4 pt -111.26 148.08 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 54.3 p -91.7 -178.66 5.12 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.446 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.689 ' HD3' ' HB2' ' B' ' 525' ' ' TYR . 26.6 ttm180 -55.99 -52.3 64.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.55 -48.35 81.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.352 -177.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.7 mm-40 -57.21 -46.77 82.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.605 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.49 HD13 ' HB2' ' B' ' 491' ' ' PHE . 9.6 tt -61.76 -49.29 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.051 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.415 HG23 ' O ' ' B' ' 498' ' ' ARG . 94.7 t -63.15 -30.68 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.878 0.371 . . . . 0.0 111.008 -176.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.11 -36.65 55.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.696 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 67.4 mt -65.63 -41.19 92.94 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.876 0.37 . . . . 0.0 111.506 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 7.3 p -84.25 8.84 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.17 0.51 . . . . 0.0 111.206 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.655 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.6 t -57.46 -53.05 69.6 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.054 -179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.655 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 17.1 Cg_exo -69.09 0.2 5.48 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 122.409 2.073 . . . . 0.0 112.93 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.448 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 81.6 m-85 -109.56 -69.35 0.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.822 0.344 . . . . 0.0 110.565 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 516' ' ' PHE . 70.0 mt -86.75 -16.85 35.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.626 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.22 -15.29 65.26 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.277 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -84.18 -11.91 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.182 0.515 . . . . 0.0 110.2 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -123.03 93.71 48.0 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.692 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.51 -54.14 5.95 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.641 2.894 . . . . 0.0 113.555 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.74 -34.91 70.02 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.446 HD13 ' HA ' ' B' ' 515' ' ' LEU . 4.4 tp -80.56 -39.95 26.78 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.001 0.429 . . . . 0.0 110.257 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 2.9 t80 -67.61 -38.65 84.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.852 178.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -65.69 -42.66 90.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.68 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -57.5 -48.05 80.27 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.437 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.2 OUTLIER -58.91 -46.58 87.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.348 -178.872 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.96 -44.74 96.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.393 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -64.31 -40.53 96.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.712 -177.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -69.9 -41.97 73.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.507 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.47 HD21 ' HZ ' ' A' ' 200' ' ' PHE . 78.2 mt -77.93 -6.89 55.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.104 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 72.27 32.17 62.92 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.043 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . 0.689 ' HB2' ' HD3' ' B' ' 498' ' ' ARG . 64.4 t80 -103.42 88.5 3.12 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -82.45 46.02 1.01 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.216 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 64.2 20.06 12.03 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.275 -176.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 30.6 p . . . . . 0 C--O 1.247 0.968 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.545 179.876 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 121.399 0.618 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 25.8 p-10 -125.55 -37.87 2.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.129 179.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -136.94 -36.12 0.69 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.747 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 156.45 177.68 29.84 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 m 62.06 84.87 0.13 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.297 0.57 . . . . 0.0 110.83 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -124.15 164.9 18.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.394 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -71.55 -71.65 0.26 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.075 0.464 . . . . 0.0 110.905 -177.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -108.93 -33.41 6.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.955 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 161.67 -147.07 13.03 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.821 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -169.46 12.29 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.937 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -143.76 -74.8 0.26 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.884 0.342 . . . . 0.0 111.076 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 24.0 m -131.43 101.62 15.87 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.396 -178.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.92 -62.79 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.795 2.33 . . . . 0.0 111.868 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 30.1 m -115.54 141.34 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.436 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -115.47 26.85 9.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.521 0.677 . . . . 0.0 109.712 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.61 -1.15 32.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.548 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 50.7 mt 72.91 146.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.754 0.659 . . . . 0.0 111.297 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -105.47 -62.37 1.37 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.331 176.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 16.0 m -154.11 101.19 2.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.09 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.555 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 24.5 Cg_exo -63.85 152.15 81.99 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.433 2.089 . . . . 0.0 111.112 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -131.38 150.56 52.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.894 0.378 . . . . 0.0 111.399 -175.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.71 144.5 9.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.383 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.78 -47.96 17.72 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 112.104 -173.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt 71.57 -38.64 0.43 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.19 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -65.31 -26.15 67.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.571 0.7 . . . . 0.0 109.195 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -55.93 -24.27 36.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.312 174.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.578 HD13 HD23 ' B' ' 504' ' ' LEU . 75.4 mt -75.47 154.61 36.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.237 0.541 . . . . 0.0 111.275 -176.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.66 142.58 58.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.695 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . 0.565 ' HB ' ' HD3' ' A' ' 175' ' ' LYS . 5.1 p -58.4 -31.67 43.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.875 0.369 . . . . 0.0 110.577 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.32 -38.98 88.95 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.542 175.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.609 HG21 ' HG2' ' B' ' 500' ' ' GLU . 39.0 m -67.92 -40.07 83.44 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 75.0 mt -63.85 -44.47 93.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.332 0.587 . . . . 0.0 110.006 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -62.59 -33.66 75.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.169 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.638 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 28.4 ttm180 -67.11 -43.67 81.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.078 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.5 ' HA ' HG11 ' B' ' 495' ' ' VAL . 69.7 t80 -54.88 -56.31 20.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.838 174.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -67.23 -31.84 72.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.433 -174.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -73.06 -43.42 61.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.705 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -66.91 -41.67 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.546 -178.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.98 -4.36 52.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.135 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 56.84 56.65 5.26 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.22 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 88.9 mt -88.57 124.04 66.74 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.339 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.85 127.71 24.36 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.749 2.3 . . . . 0.0 111.548 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.548 ' HB ' HD11 ' A' ' 173' ' ' LEU . 1.3 p -138.97 159.03 43.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.089 0.471 . . . . 0.0 112.135 -175.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -96.04 149.84 36.48 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.01 176.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.23 145.24 71.72 Favored 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.757 2.305 . . . . 0.0 112.29 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.89 46.94 4.35 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.231 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . 0.548 HD11 ' HB ' ' A' ' 169' ' ' THR . 99.1 mt -85.7 146.11 26.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.223 0.535 . . . . 0.0 111.855 -177.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.537 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 19.7 t-20 -108.15 159.36 16.66 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.725 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.565 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.8 tptm -49.17 -49.27 43.34 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 122.765 0.426 . . . . 0.0 111.143 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.8 -39.92 91.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.101 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -60.27 -39.58 87.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.125 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 86.3 mt -59.21 -54.68 44.18 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.051 176.393 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.529 HG22 ' O ' ' A' ' 175' ' ' LYS . 21.5 t -56.93 -40.82 74.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 123.833 0.708 . . . . 0.0 111.296 -176.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.7 -50.92 71.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.722 0.296 . . . . 0.0 110.874 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -65.59 -42.88 93.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.568 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 78.9 t -58.38 -49.29 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.35 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.02 94.11 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.575 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -59.42 -45.65 90.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.932 0.396 . . . . 0.0 110.684 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 -83.69 -22.92 31.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.451 . . . . 0.0 110.618 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.568 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.0 t80 -65.47 -41.79 92.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.747 -178.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -71.63 -11.36 60.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.411 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 4.9 p -116.46 22.91 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.912 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 78.2 mt -75.59 125.4 88.63 Favored Pre-proline 0 C--O 1.236 0.359 0 CA-C-O 120.58 0.229 . . . . 0.0 110.456 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 12.6 Cg_exo -70.18 126.41 13.0 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.992 2.461 . . . . 0.0 110.963 174.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 3.8 p -147.21 155.26 11.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.94 -175.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -136.09 133.03 36.88 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.271 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.63 -64.67 0.74 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -55.91 -53.61 54.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.434 -171.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.99 -43.94 97.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.743 0.306 . . . . 0.0 111.822 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 33.3 m -68.61 -43.14 77.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.237 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.13 -49.91 76.08 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 24.9 m -57.85 -46.69 84.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.864 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.38 -49.64 76.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.772 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.535 ' CD1' HD23 ' B' ' 488' ' ' LEU . 61.2 t80 -61.93 -54.77 37.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.215 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 73.6 mt -58.08 -46.05 88.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.198 0.523 . . . . 0.0 110.872 -177.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.58 -40.27 96.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.152 -176.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 16.5 m -70.67 -54.61 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.124 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 43.8 t -61.47 -35.59 67.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -73.12 -17.6 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -92.42 -49.63 6.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.729 0.3 . . . . 0.0 110.973 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -169.87 159.82 8.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.278 0.561 . . . . 0.0 109.643 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.409 ' N ' ' HD2' ' A' ' 208' ' ' LYS . 11.7 mptt -87.43 137.62 32.18 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.692 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . 0.513 ' N ' HD21 ' A' ' 209' ' ' ASN . 0.1 OUTLIER -52.53 162.52 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.448 0.906 . . . . 0.0 113.448 -174.11 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -128.25 -162.78 1.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.386 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 18.8 m 70.65 11.06 7.22 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.535 0.522 . . . . 0.0 111.199 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -97.71 -47.57 5.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.151 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 54.4 tp -139.16 136.21 34.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.773 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . 0.407 ' HD2' ' N ' ' A' ' 214' ' ' LYS . 0.3 OUTLIER -108.9 140.3 42.56 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.583 -179.429 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.7 -169.25 1.47 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.544 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 63.97 27.98 14.37 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.0 m -122.17 14.95 10.61 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 101.95 95.03 2.25 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.899 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 12.3 p -142.47 143.96 25.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.697 0.284 . . . . 0.0 110.578 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 8.1 p80 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.136 178.784 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 121.219 0.533 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -104.74 -49.45 3.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -109.43 162.26 14.53 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.577 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 15.2 m -63.65 133.28 53.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -82.8 -70.86 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.817 0.342 . . . . 0.0 110.671 -177.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -155.11 10.24 0.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.429 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 116.64 -65.14 0.33 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 42.9 t -75.04 123.14 30.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -165.9 -51.62 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.984 -0.627 . . . . 0.0 111.858 178.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.5 t -69.32 -16.06 63.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.48 0.181 . . . . 0.0 110.834 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -60.4 3.56 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.79 175.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 39.1 m -65.28 -26.67 68.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.88 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.71 -52.74 59.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.049 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.502 ' O ' HG22 ' B' ' 471' ' ' VAL . 63.7 t80 -54.88 -58.81 6.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.614 176.853 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -65.01 -27.63 68.96 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -172.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -71.36 -42.13 68.86 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.957 0.408 . . . . 0.0 109.992 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -61.51 -45.49 93.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.191 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.511 HG11 HD22 ' B' ' 509' ' ' LEU . 84.8 t -55.95 -47.66 79.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.797 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -59.41 -40.58 87.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.433 -178.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -79.41 -35.02 41.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.728 0.299 . . . . 0.0 111.198 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -70.91 -46.72 62.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 50.7 mt -61.04 -43.55 98.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.494 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 25.6 ttt180 70.68 -61.2 0.48 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.154 0.909 . . . . 0.0 112.326 172.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' B' ' 480' ' ' ALA . 30.8 t -62.87 145.19 55.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.719 -176.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.44 -50.84 63.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.627 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.61 -24.4 64.57 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.359 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.555 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.88 -56.08 15.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.053 0.454 . . . . 0.0 110.186 177.077 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.404 ' CE2' HD11 ' B' ' 485' ' ' LEU . 62.4 t80 -66.74 -37.16 84.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.255 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.613 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 34.2 tt0 -63.99 -45.87 87.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.438 179.053 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -60.39 -39.84 88.75 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.493 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 67.5 t80 -55.57 -49.91 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.135 174.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.404 HD11 ' CE2' ' B' ' 481' ' ' TYR . 88.6 mt -65.06 -33.97 77.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.188 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.912 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 26.1 mtt180 -64.85 -41.3 95.81 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.893 0.377 . . . . 0.0 110.277 177.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 61.4 m -60.87 -34.73 75.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.979 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.535 HD23 ' CD1' ' A' ' 200' ' ' PHE . 44.3 mt -66.99 -52.41 42.98 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.086 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . 0.43 HG21 ' HA ' ' B' ' 486' ' ' ARG . 10.8 m -59.6 -42.24 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -177.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.579 ' HA ' ' HG2' ' B' ' 493' ' ' GLN . 17.1 pt -70.47 -32.31 49.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.146 -0.622 . . . . 0.0 111.132 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -64.97 -45.7 84.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.196 0.522 . . . . 0.0 110.176 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -63.94 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.029 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . 0.802 ' HG3' HG22 ' B' ' 495' ' ' VAL . 10.7 pt20 -93.68 13.3 22.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.303 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 67.6 35.59 4.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.308 173.505 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.802 HG22 ' HG3' ' B' ' 493' ' ' GLN . 64.8 t -88.8 -52.91 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.029 0.443 . . . . 0.0 110.061 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.436 HG12 HG13 ' B' ' 490' ' ' ILE . 49.5 pt -110.08 145.02 17.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.125 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 497' ' ' SER . . . . . 0.429 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.2 t -84.93 178.49 7.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.981 0.419 . . . . 0.0 110.385 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.58 ' O ' HG22 ' B' ' 502' ' ' VAL . 9.5 ttp180 -55.38 -47.7 75.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.251 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.09 -53.11 62.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.162 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . 0.609 ' HG2' HG21 ' A' ' 157' ' ' THR . 1.9 mp0 -56.6 -40.31 75.09 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.78 HD21 HD23 ' B' ' 523' ' ' LEU . 67.8 tp -60.03 -49.39 77.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 110.939 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.58 HG22 ' O ' ' B' ' 498' ' ' ARG . 8.1 t -68.06 -30.32 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.41 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.47 -46.08 70.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.344 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.578 HD23 HD13 ' A' ' 153' ' ' LEU . 86.4 mt -62.37 -40.31 96.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.988 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -87.23 6.78 2.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.084 0.468 . . . . 0.0 111.194 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.651 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 40.3 t -56.19 -52.98 68.59 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.733 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.651 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.3 Cg_exo -66.58 -7.94 19.5 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.055 1.837 . . . . 0.0 113.056 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . 0.458 ' O ' ' HD3' ' B' ' 511' ' ' LYS . 96.5 m-85 -100.15 -50.18 4.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.516 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . 0.511 HD22 HG11 ' B' ' 471' ' ' VAL . 86.9 mt -106.6 -8.45 16.96 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.392 -177.241 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.44 -20.17 69.42 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.269 -176.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.458 ' HD3' ' O ' ' B' ' 508' ' ' PHE . 0.0 OUTLIER -83.05 -5.11 58.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.745 0.307 . . . . 0.0 110.652 177.797 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.413 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 58.7 m-85 -118.71 93.23 45.79 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 9.4 Cg_endo -51.8 -54.23 5.66 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.483 2.788 . . . . 0.0 113.673 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -65.1 -44.57 88.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.303 0.573 . . . . 0.0 110.429 -176.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.64 -42.72 98.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.797 -176.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -72.09 -31.98 66.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.691 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -70.26 -34.69 73.12 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.506 177.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -60.25 -49.22 78.47 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.663 ' O ' HD11 ' B' ' 523' ' ' LEU . 33.1 t80 -54.98 -53.53 54.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.506 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -56.17 -40.94 74.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.784 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -63.46 -35.94 82.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.978 0.418 . . . . 0.0 110.459 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -65.07 -41.4 95.13 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.653 179.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.78 HD23 HD21 ' B' ' 501' ' ' LEU . 3.6 mp -76.98 -15.35 59.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.205 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.62 34.06 63.27 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -171.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -97.8 106.62 18.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.013 -0.593 . . . . 0.0 110.494 -174.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . 0.469 ' HG2' ' OXT' ' B' ' 528' ' ' SER . 8.9 ptpp? -100.88 39.88 1.34 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.422 -178.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 70.87 8.0 6.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.497 -169.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 528' ' ' SER . . . . . 0.469 ' OXT' ' HG2' ' B' ' 526' ' ' LYS . 32.6 t . . . . . 0 C--O 1.247 0.958 0 CA-C-N 114.576 -1.193 . . . . 0.0 108.187 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.477 0.92 0 CA-C-O 120.767 0.317 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -114.42 123.33 49.17 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -82.61 -2.42 53.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.878 0.371 . . . . 0.0 111.584 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 114.5 30.97 2.27 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.458 178.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.6 t -137.45 144.49 42.33 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -119.7 -41.55 2.68 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.062 0.458 . . . . 0.0 110.81 -178.128 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -119.72 -176.22 3.12 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.16 -52.38 65.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.709 0.29 . . . . 0.0 111.531 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 161.94 40.47 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.067 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 74.06 -115.21 4.83 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.51 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -97.2 149.24 22.23 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.004 0.431 . . . . 0.0 110.603 -178.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' SER . . . . . 0.45 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 50.0 m -103.86 128.4 27.35 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.443 179.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 21.9 Cg_exo -65.27 -34.66 44.1 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.782 2.321 . . . . 0.0 111.91 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.0 m -97.94 107.9 20.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.371 0.605 . . . . 0.0 111.064 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -112.57 96.32 5.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.018 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -103.97 125.5 50.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.432 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -152.64 113.95 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.384 -177.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' B' ' 477' ' ' SER . 8.0 t70 -62.6 -65.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 170.389 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.5 m -154.24 105.7 2.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.42 178.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' PRO . . . . . 0.459 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 19.3 Cg_exo -63.47 148.1 92.81 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.069 1.846 . . . . 0.0 110.888 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -106.32 158.42 16.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.828 0.347 . . . . 0.0 111.038 -173.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.4 p -110.22 131.79 60.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.412 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -87.92 124.88 34.14 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 88.6 mt -110.17 5.97 22.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -94.01 -15.93 24.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -73.48 -19.5 60.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.397 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' LEU . . . . . 0.497 HD12 HD22 ' B' ' 504' ' ' LEU . 72.5 mt -71.41 156.52 39.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 111.39 -177.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -69.98 158.75 35.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.365 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.51 -41.4 92.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.81 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -64.98 -39.78 93.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.507 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' THR . . . . . 0.421 ' CG2' HG23 ' B' ' 496' ' ' ILE . 25.0 m -57.36 -47.91 80.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.096 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.35 -41.86 96.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.684 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -65.98 -33.52 75.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.623 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' ARG . . . . . 0.467 ' HD3' ' O ' ' B' ' 495' ' ' VAL . 17.9 ttt85 -67.29 -44.4 79.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.212 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' TYR . . . . . 0.565 ' HH ' HD11 ' A' ' 189' ' ' ILE . 65.5 t80 -53.47 -49.98 66.3 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.444 172.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' LYS . . . . . 0.651 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 9.1 mtpm? -56.9 -42.17 79.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.802 -179.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -72.94 -47.65 43.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.602 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -71.79 -31.58 66.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' PHE . . . . . 0.427 ' CE1' HG21 ' B' ' 490' ' ' ILE . 32.3 m-85 -93.29 1.96 56.78 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.064 178.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 58.2 73.95 0.45 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.448 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 92.4 mt -114.73 107.66 50.28 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.415 178.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -67.01 126.2 14.82 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.404 2.069 . . . . 0.0 111.419 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' THR . . . . . 0.469 HG23 ' HE2' ' A' ' 162' ' ' LYS . 15.0 p -136.55 165.26 26.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.266 -175.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' ARG . . . . . 0.405 HH11 ' HD2' ' A' ' 170' ' ' ARG . 47.8 mtt180 -99.61 149.04 35.53 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.401 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.53 137.33 73.12 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.849 2.366 . . . . 0.0 112.245 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 110.26 36.54 1.94 Allowed Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -177.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.36 144.38 27.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.135 0.493 . . . . 0.0 111.386 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' ASN . . . . . 0.619 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 59.4 m-80 -136.18 177.05 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.689 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 175' ' ' LYS . . . . . 0.563 ' O ' HG21 ' A' ' 179' ' ' VAL . 20.9 tptm -53.03 -56.07 18.91 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.405 0.44 . . . . 0.0 111.791 -176.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -59.67 -35.5 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.182 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.6 mm-40 -66.63 -46.83 74.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.271 -179.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 178' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 69.7 mt -60.04 -48.02 83.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 179' ' ' VAL . . . . . 0.563 HG21 ' O ' ' A' ' 175' ' ' LYS . 49.0 t -58.27 -43.33 85.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.943 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -45.94 91.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.581 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 72.5 mt -66.43 -47.64 83.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 CA-C-O 120.994 0.426 . . . . 0.0 110.616 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 182' ' ' VAL . . . . . 0.447 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 74.1 t -59.87 -49.58 83.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.499 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.53 -40.49 98.78 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.412 -0.423 . . . . 0.0 112.255 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 44.2 t -54.91 -48.55 72.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.807 0.337 . . . . 0.0 110.947 178.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -83.64 -24.95 31.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -177.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 186' ' ' PHE . . . . . 0.567 ' HE1' HD11 ' B' ' 490' ' ' ILE . 39.1 t80 -64.72 -39.43 93.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 122.87 0.468 . . . . 0.0 110.963 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -74.75 5.53 4.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.682 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.4 p -133.43 24.02 4.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.659 0.266 . . . . 0.0 111.477 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 189' ' ' ILE . . . . . 0.565 HD11 ' HH ' ' A' ' 161' ' ' TYR . 68.4 mt -86.73 117.69 69.03 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.612 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.66 122.59 9.78 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.808 2.339 . . . . 0.0 111.168 175.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 191' ' ' VAL . . . . . 0.537 HG23 ' HB3' ' B' ' 485' ' ' LEU . 8.4 p -134.5 147.36 29.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.906 0.384 . . . . 0.0 110.97 -175.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -118.04 118.47 32.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.142 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 193' ' ' GLU . . . . . 0.497 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 86.8 tt0 -48.78 -58.78 4.26 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 0.0 112.633 -173.458 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 194' ' ' LYS . . . . . 0.417 ' C ' ' HD2' ' A' ' 194' ' ' LYS . 0.5 OUTLIER -64.68 -49.18 71.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.497 0.189 . . . . 0.0 111.166 -173.368 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.0 -46.51 84.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.792 0.329 . . . . 0.0 111.369 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.5 m -63.03 -41.28 99.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.43 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 59.1 mt -60.42 -46.37 90.24 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 175.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 47.2 m -58.61 -46.68 86.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.732 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 66.1 m -57.05 -54.61 44.84 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.545 177.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 200' ' ' PHE . . . . . 0.505 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.7 t80 -56.56 -53.11 61.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.348 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ILE . . . . . 0.408 HG13 ' O ' ' A' ' 197' ' ' LEU . 74.7 mt -55.85 -52.09 52.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.484 -175.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -70.51 -25.94 63.36 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.2 m -72.17 -46.36 56.67 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.706 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' VAL . . . . . 0.471 HG22 ' O ' ' A' ' 200' ' ' PHE . 22.0 t -76.2 -35.33 27.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.204 -175.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' ARG . . . . . 0.559 ' HD2' ' OE2' ' B' ' 464' ' ' GLU . 17.9 mtp180 -64.94 -44.76 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.068 178.036 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -95.04 80.98 3.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.544 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 13.4 t70 67.47 124.31 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.53 0.732 . . . . 0.0 111.205 -176.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 208' ' ' LYS . . . . . 0.604 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 0.3 OUTLIER -87.77 22.07 2.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.251 -170.183 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 65.03 91.5 0.08 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.302 0.573 . . . . 0.0 110.494 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 210' ' ' LYS . . . . . 0.423 ' HB2' ' HZ3' ' A' ' 210' ' ' LYS . 0.0 OUTLIER -126.35 85.02 2.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.182 -177.151 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 4.8 p -73.76 -30.8 63.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.541 173.303 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 73.53 -36.28 0.34 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.854 172.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 83.7 mt 60.49 94.66 0.04 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.53 0.681 . . . . 0.0 110.831 -177.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -126.16 -0.37 7.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.05 -175.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -91.23 82.62 5.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 110.982 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -110.1 -19.79 12.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.378 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 31.2 t -108.31 137.24 46.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.003 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 172.51 -19.32 0.06 OUTLIER Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.858 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.76 150.56 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 O-C-N 122.535 -0.391 . . . . 0.0 111.358 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.724 -0.655 . . . . 0.0 109.554 179.378 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.804 0.335 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -71.75 -48.35 47.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.342 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -86.21 154.79 21.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.479 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 20.4 t -117.88 160.17 21.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.092 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -97.64 -51.64 4.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.881 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -135.22 2.35 3.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.675 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 77.44 -52.28 3.43 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.076 -176.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 40.8 t -76.39 136.67 24.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 131.01 38.25 0.29 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.815 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 26.4 p -81.16 3.65 22.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.715 0.293 . . . . 0.0 110.947 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 464' ' ' GLU . . . . . 0.559 ' OE2' ' HD2' ' A' ' 205' ' ' ARG . 1.7 mp0 -54.98 -44.45 74.46 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 175.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.0 t -60.5 -40.35 91.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.023 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 466' ' ' LEU . . . . . 0.494 HD22 ' HE3' ' B' ' 470' ' ' LYS . 8.9 tt -62.14 -49.33 76.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.798 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 467' ' ' PHE . . . . . 0.525 ' O ' HG22 ' B' ' 471' ' ' VAL . 75.5 t80 -54.16 -58.04 8.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.721 176.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 468' ' ' PHE . . . . . 0.401 ' HE1' ' HZ ' ' B' ' 484' ' ' PHE . 46.1 m-85 -64.54 -29.59 70.62 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -174.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.01 -45.04 78.75 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 470' ' ' LYS . . . . . 0.494 ' HE3' HD22 ' B' ' 466' ' ' LEU . 89.8 mttt -64.31 -40.14 95.32 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.701 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 471' ' ' VAL . . . . . 0.525 HG22 ' O ' ' B' ' 467' ' ' PHE . 87.1 t -59.79 -42.19 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.499 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.49 -46.36 83.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.921 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -75.67 -34.35 60.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.375 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 474' ' ' ALA . . . . . 0.42 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -69.75 -53.8 16.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.967 -175.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.46 -33.98 76.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.207 -176.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 69.2 -59.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.962 0.789 . . . . 0.0 112.04 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 477' ' ' SER . . . . . 0.574 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.5 t -62.52 126.68 28.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.057 0.456 . . . . 0.0 111.261 -178.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.07 -30.36 70.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.023 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -72.79 -40.71 65.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.924 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 480' ' ' ALA . . . . . 0.459 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.46 -43.41 97.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.468 176.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 481' ' ' TYR . . . . . 0.456 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 47.2 t80 -66.53 -38.53 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.081 178.043 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 482' ' ' GLU . . . . . 0.498 ' HG3' ' CG1' ' A' ' 191' ' ' VAL . 37.8 tt0 -60.62 -40.48 92.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.204 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.43 -42.52 99.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 484' ' ' PHE . . . . . 0.401 ' HZ ' ' HE1' ' B' ' 468' ' ' PHE . 46.6 t80 -55.74 -42.61 75.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.384 172.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 485' ' ' LEU . . . . . 0.537 ' HB3' HG23 ' A' ' 191' ' ' VAL . 92.1 mt -66.99 -32.97 74.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 486' ' ' ARG . . . . . 0.564 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.2 OUTLIER -59.68 -43.24 94.08 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.113 0.482 . . . . 0.0 110.059 172.591 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.4 m -60.84 -35.67 77.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.155 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 488' ' ' LEU . . . . . 0.505 HD22 ' CD1' ' A' ' 200' ' ' PHE . 41.9 mt -68.52 -46.17 70.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.586 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.9 m -65.34 -42.06 92.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.555 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 490' ' ' ILE . . . . . 0.567 HD11 ' HE1' ' A' ' 186' ' ' PHE . 11.3 pt -69.98 -29.64 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.926 178.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -68.23 -42.4 79.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.225 0.536 . . . . 0.0 109.789 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -59.24 -41.29 88.41 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.126 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -89.01 18.02 5.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.169 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 54.28 48.19 21.35 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.765 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 495' ' ' VAL . . . . . 0.467 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 83.2 t -98.21 -42.45 11.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.85 175.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 496' ' ' ILE . . . . . 0.421 HG23 ' CG2' ' A' ' 157' ' ' THR . 41.7 pt -115.82 151.23 17.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.695 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 78.2 p -89.84 177.29 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.624 0.249 . . . . 0.0 110.5 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 498' ' ' ARG . . . . . 0.604 ' HD3' ' HB3' ' A' ' 208' ' ' LYS . 22.9 mtm180 -52.38 -54.17 35.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.449 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.66 -48.48 77.5 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.49 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.13 -39.81 75.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.722 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 501' ' ' LEU . . . . . 0.525 HD23 HD23 ' B' ' 523' ' ' LEU . 53.7 tp -62.95 -47.4 83.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 502' ' ' VAL . . . . . 0.453 HG11 ' CE1' ' B' ' 516' ' ' PHE . 0.2 OUTLIER -64.62 -31.3 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.266 0.555 . . . . 0.0 109.923 -179.629 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -67.26 -45.86 75.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.604 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 504' ' ' LEU . . . . . 0.497 HD22 HD12 ' A' ' 153' ' ' LEU . 77.9 mt -64.2 -41.53 97.03 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 8.3 p -85.37 3.8 3.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.931 0.396 . . . . 0.0 111.113 -178.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 506' ' ' SER . . . . . 0.59 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 22.9 t -55.7 -51.54 79.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.057 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 507' ' ' PRO . . . . . 0.59 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 50.4 Cg_exo -57.03 -35.04 98.78 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.877 1.718 . . . . 0.0 112.486 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -73.74 -40.86 63.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.27 -174.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 509' ' ' LEU . . . . . . . . . . . . . 81.2 mt -101.95 4.71 40.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.82 0.343 . . . . 0.0 111.242 -176.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.48 -18.41 69.75 Favored Glycine 0 N--CA 1.455 -0.068 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.766 -177.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 511' ' ' LYS . . . . . 0.451 ' HD2' ' N ' ' B' ' 511' ' ' LYS . 2.6 mptp? -93.78 -4.71 49.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.076 0.465 . . . . 0.0 109.79 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 512' ' ' PHE . . . . . 0.42 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 43.7 m-85 -129.56 87.28 53.35 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.644 -172.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.55 -43.45 58.84 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.229 2.619 . . . . 0.0 113.18 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.69 -44.4 96.58 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.133 0.492 . . . . 0.0 110.709 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 515' ' ' LEU . . . . . 0.458 HD12 ' HA ' ' B' ' 515' ' ' LEU . 1.4 tp -69.28 -46.61 66.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.423 -173.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 516' ' ' PHE . . . . . 0.491 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 44.5 t80 -66.78 -36.38 82.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.907 0.384 . . . . 0.0 110.623 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.69 -41.55 75.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.545 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 518' ' ' TRP . . . . . 0.421 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 29.3 t90 -55.14 -48.21 74.02 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 175.542 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 519' ' ' PHE . . . . . 0.509 ' O ' HD12 ' B' ' 523' ' ' LEU . 19.0 t80 -56.99 -46.96 81.87 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.622 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 520' ' ' LYS . . . . . 0.491 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 83.1 mttt -56.33 -50.42 71.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.259 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.14 -32.81 74.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.452 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -69.15 -44.12 72.96 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.369 0.604 . . . . 0.0 109.5 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 523' ' ' LEU . . . . . 0.525 HD23 HD23 ' B' ' 501' ' ' LEU . 9.7 mp -73.95 -19.72 60.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.674 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.23 13.99 69.94 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -82.98 118.51 23.55 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.186 0.517 . . . . 0.0 110.455 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -134.02 40.51 3.06 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.659 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 58.1 28.46 16.42 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.565 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.723 -0.655 . . . . 0.0 110.177 -175.839 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -59.02 132.79 49.36 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.546 2.164 . . . . 0.0 111.737 -178.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -102.72 138.23 39.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.239 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.68 125.3 40.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.297 0.57 . . . . 0.0 111.277 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 19.5 t0 -81.81 114.38 20.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.589 174.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.73 HD23 HD11 ' B' ' 504' ' ' LEU . 56.3 mt -100.01 -0.45 39.22 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.335 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -82.66 -19.36 38.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.503 -179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' B' ' 504' ' ' LEU . 28.8 pt20 -71.01 -26.8 63.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.847 178.309 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.552 HD21 HD13 ' B' ' 504' ' ' LEU . 86.5 mt -65.25 149.21 50.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.687 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -65.73 152.53 44.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.223 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.472 HG22 ' HD3' ' A' ' 175' ' ' LYS . 57.6 t -55.93 -40.1 60.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.309 0.576 . . . . 0.0 109.796 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.84 -39.04 93.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.527 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.404 HG23 ' HA ' ' B' ' 496' ' ' ILE . 23.0 m -64.21 -44.77 90.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.14 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.07 -41.7 90.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.15 0.5 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.63 -32.39 73.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.418 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.593 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.2 ttm180 -67.47 -44.46 78.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.013 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -51.5 -49.58 61.59 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.063 0.458 . . . . 0.0 110.224 172.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.419 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.4 mtpm? -63.52 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.884 -178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -79.89 -39.14 31.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.636 0.255 . . . . 0.0 111.328 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -77.87 -32.82 52.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.96 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -91.06 -4.95 55.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.971 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.8 mptt 56.67 81.78 0.13 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.539 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.43 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 90.3 mt -116.8 95.36 46.33 Favored Pre-proline 0 C--N 1.325 -0.466 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 21.0 Cg_endo -61.73 127.27 21.1 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.798 2.332 . . . . 0.0 111.405 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.412 HG21 ' CE ' ' A' ' 162' ' ' LYS . 10.8 p . . . . . 0 C--N 1.319 -0.738 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.221 -174.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.4 mt . . . . . 0 C--O 1.234 0.284 0 CA-C-O 120.948 0.404 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.58 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 13.9 m120 -121.42 174.96 6.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.258 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.632 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.7 tptm -54.88 -53.1 59.8 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.473 0.483 . . . . 0.0 111.371 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.38 -39.01 85.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.675 0.274 . . . . 0.0 111.196 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -62.12 -46.29 89.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.271 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 84.7 mt -59.05 -49.68 76.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 175' ' ' LYS . 39.0 t -58.73 -40.54 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.344 -176.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -64.72 -49.17 71.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.929 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.32 -47.82 88.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.821 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.24 -47.71 89.4 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.177 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 183' ' ' GLY . . . . . 0.5 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -62.45 -38.96 97.18 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.671 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.46 -41.94 99.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -81.04 -31.6 34.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.651 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.98 -27.87 69.13 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 122.87 0.468 . . . . 0.0 110.922 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 63.5 mttp -72.8 -6.71 46.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.34 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.9 t -133.09 60.74 1.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 110.704 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.974 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 68.8 mt -110.75 119.0 47.37 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.169 175.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.01 129.24 19.12 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.074 2.516 . . . . 0.0 111.214 175.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.0 p -142.45 154.65 18.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.696 -173.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.42 122.01 21.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.638 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 29.0 tt0 -48.79 -64.13 0.89 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.413 0.445 . . . . 0.0 112.146 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -56.86 -53.04 62.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -172.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -66.88 -42.13 86.09 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.712 -176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.7 m -64.92 -40.79 95.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.978 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 52.5 mt -63.38 -43.9 96.29 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 53.9 m -58.58 -48.99 79.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.097 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 74.7 m -58.36 -48.73 79.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.863 0.364 . . . . 0.0 110.704 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.532 ' CD1' HD22 ' B' ' 488' ' ' LEU . 42.2 t80 -57.33 -55.65 32.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.079 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.544 HD11 ' HE2' ' B' ' 468' ' ' PHE . 85.4 mt -57.64 -45.48 86.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.243 0.544 . . . . 0.0 110.57 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.88 -59.83 4.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.191 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 68.8 m -62.36 -45.4 93.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -174.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.537 HG11 HD23 ' B' ' 523' ' ' LEU . 51.6 t -67.39 -35.32 73.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.37 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 . . . . . 0 C--N 1.328 -0.342 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.109 178.097 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 463' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 11.6 t . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 121.13 0.491 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -66.6 -44.0 83.29 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 10.7 t -65.24 -33.28 75.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' B' ' 463' ' ' THR . 53.9 tp -60.73 -49.22 78.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.992 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 471' ' ' VAL . 78.1 t80 -55.78 -51.74 66.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.364 176.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.544 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.7 m-85 -65.45 -34.97 79.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.535 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.62 -45.44 94.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -58.85 -48.75 80.26 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.812 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 467' ' ' PHE . 63.3 t -58.92 -47.07 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.875 0.369 . . . . 0.0 110.658 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -39.37 90.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -79.85 -30.77 40.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.196 -175.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.457 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -80.0 -47.69 14.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.611 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 475' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 508' ' ' PHE . 24.9 mt -66.53 -40.39 89.11 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.371 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 71.25 -46.05 0.63 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.525 0.73 . . . . 0.0 112.692 173.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 33.8 t -72.13 136.68 46.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.671 0.272 . . . . 0.0 110.493 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.82 97.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.823 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.55 -29.65 64.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.475 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -68.34 -42.38 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.408 . . . . 0.0 110.425 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -67.48 -37.36 82.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 44.6 tt0 -60.26 -42.1 94.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 174.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.475 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 4.1 t30 -53.59 -49.16 68.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.277 176.187 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -54.07 -47.69 71.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.29 0.567 . . . . 0.0 110.507 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.01 -31.62 72.29 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.134 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.974 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 17.1 mtt85 -67.49 -37.55 83.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.39 . . . . 0.0 110.258 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.4 m -62.17 -36.37 81.67 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.4 mt -66.46 -47.43 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.287 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.538 HG22 ' HA ' ' B' ' 486' ' ' ARG . 12.6 m -64.7 -42.45 95.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.756 -0.377 . . . . 0.0 111.902 -177.371 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.422 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 26.1 pt -69.22 -31.27 49.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.988 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -63.96 -45.74 87.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -64.49 -35.94 82.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -81.92 17.57 1.52 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.693 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 64.22 29.54 13.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 111.064 172.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.593 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 95.8 t -93.33 -55.12 6.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.377 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.404 ' HA ' HG23 ' A' ' 157' ' ' THR . 41.3 pt -104.35 149.49 8.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.802 -0.359 . . . . 0.0 111.194 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.43 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.1 m -78.64 173.77 12.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.512 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -57.78 -58.82 6.7 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.219 0.533 . . . . 0.0 111.076 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 499' ' ' ALA . . . . . 0.661 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -60.81 -38.04 84.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.933 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 7.9 mm-40 -56.4 -38.3 71.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.195 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.9 tp -64.84 -52.46 56.56 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.942 177.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -62.72 -40.66 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.929 -178.773 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -67.48 -37.74 83.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.422 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.73 HD11 HD23 ' A' ' 150' ' ' LEU . 10.7 tp -62.37 -41.78 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.746 0.308 . . . . 0.0 111.181 -174.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 18.0 m -86.11 14.24 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.855 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 48.3 t -57.53 -51.41 81.91 Favored Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 178.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.1 Cg_exo -61.38 -8.42 10.58 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.137 1.891 . . . . 0.0 112.738 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.442 ' HB3' HD21 ' B' ' 475' ' ' LEU . 88.2 m-85 -106.58 -61.5 1.52 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.302 -177.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.49 HD21 HG13 ' B' ' 471' ' ' VAL . 46.4 mt -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.364 -173.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.62 68.43 Favored Glycine 0 N--CA 1.454 -0.118 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.744 -176.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.29 0.567 . . . . 0.0 110.185 178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.477 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 45.7 m-85 -115.76 98.11 50.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.244 -175.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 513' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.8 Cg_endo -54.17 -46.36 34.16 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.398 2.732 . . . . 0.0 113.211 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -61.81 -38.5 88.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.175 0.512 . . . . 0.0 110.892 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 33.3 tp -74.48 -47.09 35.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.546 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 11.8 t80 -69.36 -32.22 71.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.738 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -70.14 -40.32 74.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.226 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -54.84 -48.36 72.98 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.609 ' O ' ' HG ' ' B' ' 523' ' ' LEU . 8.4 t80 -56.79 -49.71 74.53 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.652 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.604 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 94.8 mttt -59.01 -44.74 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.529 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -64.14 -35.24 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.812 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -71.79 -38.9 70.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.569 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' B' ' 519' ' ' PHE . 68.0 mt -77.1 -13.45 59.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.221 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 70.36 43.46 62.3 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -173.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 46.5 t80 . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 120.987 0.422 . . . . 0.0 109.998 -177.131 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.0 m . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.733 0.301 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' B' ' 508' ' ' PHE . 32.4 Cg_exo -57.07 136.29 75.76 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 111.392 174.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -110.06 166.07 11.23 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.667 -176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.532 HG12 ' ND2' ' B' ' 483' ' ' ASN . 6.8 p -114.01 140.48 34.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.861 176.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 12.5 t70 -106.33 124.52 49.72 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.433 HD13 HG12 ' A' ' 182' ' ' VAL . 61.7 mt -104.05 2.53 32.25 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.393 0.616 . . . . 0.0 110.624 -177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -86.39 -21.92 26.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.758 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.45 HE21 ' HB3' ' B' ' 503' ' ' GLN . 19.0 pt20 -73.34 -17.57 61.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.835 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.466 HD11 HD21 ' B' ' 504' ' ' LEU . 76.2 mt -75.1 173.1 11.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.269 0.557 . . . . 0.0 111.621 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.7 mp0 -87.6 144.8 26.5 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.33 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 178' ' ' LEU . 55.3 t -54.08 -42.26 54.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.516 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.69 -35.41 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.145 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.6 m -69.83 -42.02 74.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.767 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 162' ' ' LYS . 74.7 mt -64.56 -40.94 96.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.226 178.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 159' ' ' ARG . 27.9 mtp85 -64.71 -37.42 87.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.594 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 160' ' ' ARG . 35.2 ttm105 -66.25 -38.85 88.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.446 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.487 ' HA ' HG13 ' B' ' 495' ' ' VAL . 60.4 t80 -56.44 -51.52 68.08 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.275 172.413 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.635 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 7.4 mtpm? -60.97 -35.19 76.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.457 -177.401 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -76.43 -34.91 58.76 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.929 -176.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -77.16 -42.4 37.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.338 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.43 ' CE1' HG22 ' B' ' 490' ' ' ILE . 58.2 m-85 -89.63 3.01 53.96 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.465 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 54.5 74.57 0.34 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.7 0.625 . . . . 0.0 111.307 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 84.8 mt -111.05 144.56 30.64 Favored Pre-proline 0 C--N 1.328 -0.353 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.093 -177.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.47 162.58 33.26 Favored 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.041 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--N 1.323 -0.56 0 CA-C-O 120.949 0.404 . . . . 0.0 111.286 179.921 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 75.2 mt . . . . . 0 C--O 1.233 0.219 0 CA-C-O 121.122 0.486 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.47 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 8.2 t-20 -154.63 -171.67 3.93 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.4 tptm -64.09 -62.1 1.84 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.731 0.241 . . . . 0.0 111.251 -176.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.21 -30.13 64.3 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.701 0.286 . . . . 0.0 111.383 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 8.9 mm-40 -59.02 -55.29 37.1 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.67 0.748 . . . . 0.0 110.393 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.549 ' CD1' HG13 ' A' ' 155' ' ' VAL . 53.4 mt -64.29 -41.56 96.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.661 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.6 t -60.48 -37.92 76.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.773 -178.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.99 -53.26 48.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.874 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.426 HG21 ' HE2' ' A' ' 162' ' ' LYS . 55.3 mt -60.32 -49.33 84.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 121.01 0.433 . . . . 0.0 110.744 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.433 HG12 HD13 ' A' ' 150' ' ' LEU . 77.5 t -59.17 -49.09 84.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.939 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.58 -37.32 94.0 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.439 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 29.1 t -61.97 -42.36 99.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.93 0.395 . . . . 0.0 110.907 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 -87.26 -25.11 24.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.387 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.413 ' CE2' HG11 ' A' ' 148' ' ' VAL . 73.9 t80 -62.22 -43.58 98.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.104 0.478 . . . . 0.0 110.651 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -80.94 8.13 9.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.566 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 3.2 p -125.12 14.18 8.4 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.805 0.336 . . . . 0.0 111.274 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.442 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 75.6 mt -79.58 120.75 81.24 Favored Pre-proline 0 C--O 1.235 0.321 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.55 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.99 115.96 4.49 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.994 2.463 . . . . 0.0 111.294 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.475 HG21 ' HB3' ' B' ' 485' ' ' LEU . 3.8 p -127.89 156.21 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.068 -174.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 192' ' ' ASN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 18.9 m120 -128.97 138.33 51.89 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.729 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 27.1 tt0 -55.54 -67.28 0.3 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -72.7 -36.47 67.84 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.777 0.322 . . . . 0.0 110.965 -172.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 195' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 12.1 t70 -55.25 -49.6 71.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.993 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 90.4 m -75.54 -35.35 60.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.501 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 35.7 mt -58.45 -46.62 86.17 Favored 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.9 m -61.49 -43.53 98.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.0 m -58.08 -50.99 71.54 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.875 0.369 . . . . 0.0 111.013 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.2 t80 -65.1 -47.13 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.574 -175.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 197' ' ' LEU . 77.5 mt -61.95 -45.71 98.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.034 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -66.42 -35.96 81.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.496 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.9 m -62.41 -61.33 2.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 99.4 t -61.91 -39.71 84.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.855 -174.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 . . . . . 0 C--N 1.33 -0.246 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.742 -178.788 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 120.492 0.187 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -63.59 -53.63 48.59 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -60.67 -33.45 72.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.606 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.32 -50.7 71.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.247 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.464 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.5 t80 -52.62 -51.31 60.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.774 175.13 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.414 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 60.4 m-85 -65.02 -34.61 78.83 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.53 -38.16 88.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.935 0.398 . . . . 0.0 110.134 176.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -63.95 -47.06 81.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.223 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.489 HG13 HD21 ' B' ' 509' ' ' LEU . 75.2 t -58.74 -45.24 91.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 110.465 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -59.33 -38.06 79.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -79.01 -41.38 29.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.183 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.536 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -67.27 -43.41 81.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.184 -174.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.02 -30.65 69.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.095 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 69.23 -59.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.526 0 O-C-N 123.942 0.776 . . . . 0.0 112.104 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 32.8 t -69.06 135.09 50.26 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.238 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.17 81.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.245 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.27 -39.24 82.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.259 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.419 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.31 -45.85 89.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.104 0.478 . . . . 0.0 110.326 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.43 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 55.3 t80 -66.81 -31.5 72.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.113 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.663 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 33.5 tt0 -65.49 -42.94 91.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.668 176.336 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.532 ' ND2' HG12 ' A' ' 148' ' ' VAL . 5.5 m-20 -55.67 -46.28 77.58 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.817 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -55.94 -46.79 78.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.475 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.5 mt -67.73 -32.69 73.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -61.3 -41.33 96.8 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 120.815 0.341 . . . . 0.0 110.183 173.381 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.6 m -62.48 -35.49 79.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.224 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.453 HD22 ' CG ' ' A' ' 200' ' ' PHE . 40.2 mt -68.51 -47.19 67.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.435 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.4 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.5 m -65.33 -40.81 89.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.665 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.8 pt -69.44 -32.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.735 178.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -65.18 -42.79 93.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.21 0.529 . . . . 0.0 109.727 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.19 -38.23 82.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.87 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -86.79 15.95 5.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.475 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 60.5 26.34 15.98 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.752 0.421 . . . . 0.0 111.631 177.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 161' ' ' TYR . 53.6 t -77.13 -48.48 24.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.571 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 38.4 pt -113.3 155.58 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.997 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.453 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 81.4 p -96.27 -173.32 2.76 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -54.88 -59.54 4.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.0 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 499' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -58.6 -40.51 83.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.962 -173.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.571 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 6.7 mm-40 -59.19 -44.0 92.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.425 0.631 . . . . 0.0 109.908 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.515 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -62.3 -46.07 90.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.226 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -67.2 -32.9 59.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.728 -178.139 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.45 ' HB3' HE21 ' A' ' 152' ' ' GLN . 87.2 mt-30 -71.57 -39.9 70.29 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.466 HD21 HD11 ' A' ' 153' ' ' LEU . 74.9 mt -65.05 -38.73 91.76 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.885 0.374 . . . . 0.0 111.891 -177.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 34.9 m -84.92 11.41 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.583 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.642 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 43.8 t -61.03 -52.21 73.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.865 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 32.2 Cg_exo -63.61 -15.93 51.62 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.898 1.732 . . . . 0.0 112.378 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.442 ' CD2' ' HB2' ' A' ' 146' ' ' PRO . 94.9 m-85 -90.56 -65.73 0.99 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.082 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.489 HD21 HG13 ' B' ' 471' ' ' VAL . 87.9 mt -92.33 -5.13 52.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.438 -173.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.64 -17.1 68.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.431 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -72.57 -21.1 61.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 176.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.536 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 22.6 m-85 -123.28 86.47 51.71 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.682 -176.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.7 -46.49 29.73 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 123.155 2.57 . . . . 0.0 113.185 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -65.07 -37.55 87.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.871 0.367 . . . . 0.0 111.249 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 20.7 tp -70.4 -38.73 74.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.296 0.57 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.601 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 54.0 t80 -65.38 -35.39 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.828 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -70.01 -32.86 71.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.057 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -59.14 -48.85 80.07 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -56.28 -46.7 79.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.522 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.601 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 92.6 mttt -60.64 -41.01 94.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.186 176.057 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -61.58 -30.56 70.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -75.92 -39.32 56.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.286 0.565 . . . . 0.0 109.928 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.515 HD21 HD23 ' B' ' 501' ' ' LEU . 10.2 mp -80.76 -24.64 38.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.074 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 95.03 30.55 8.24 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.787 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.451 -0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.05 155.12 57.48 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.187 1.925 . . . . 0.0 111.737 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.29 137.04 51.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.131 0.491 . . . . 0.0 111.714 -172.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.46 133.59 28.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.086 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -87.38 -26.81 23.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.215 0.531 . . . . 0.0 111.109 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 74.6 mt 64.15 13.77 8.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.227 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.14 -16.03 34.53 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.05 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.8 -15.08 60.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.328 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 157' ' ' THR . 81.2 mt -67.44 140.4 57.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.53 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.19 157.83 36.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.797 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 88.7 t -56.16 -44.17 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.855 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -64.31 -36.58 84.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.808 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.415 HG21 HD22 ' A' ' 153' ' ' LEU . 10.4 m -63.58 -46.58 85.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.629 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.462 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 68.5 mt -62.48 -42.73 99.69 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.743 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 66.4 mtp85 -70.08 -28.81 65.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.503 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 33.7 ttm180 -72.34 -44.6 62.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.513 ' HA ' HG13 ' B' ' 495' ' ' VAL . 57.7 t80 -51.98 -51.22 58.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.081 172.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.695 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 19.8 mtpp -65.97 -29.73 70.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.279 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -81.84 -42.67 19.29 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.701 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 -68.39 -32.77 73.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.874 -175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -95.7 0.11 52.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.151 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 57.64 77.53 0.27 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.016 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 77.0 mt -120.67 134.85 24.31 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.78 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.75 155.15 65.23 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.908 2.405 . . . . 0.0 113.114 -173.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.639 ' HB ' HD11 ' A' ' 173' ' ' LEU . 67.8 p . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.358 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.639 HD11 ' HB ' ' A' ' 169' ' ' THR . 79.6 mt . . . . . 0 CA--C 1.518 -0.272 0 CA-C-O 121.217 0.532 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.584 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 93.2 m-20 -131.11 172.95 11.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.184 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.594 ' O ' HG23 ' A' ' 179' ' ' VAL . 21.5 tptm -56.39 -53.9 51.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.353 0.408 . . . . 0.0 110.339 176.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 176' ' ' ALA . . . . . 0.597 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -62.05 -34.21 75.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.423 -178.715 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.584 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.6 mm100 -67.03 -41.74 86.06 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.032 0.444 . . . . 0.0 110.879 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 88.0 mt -61.22 -47.87 84.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.837 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 175' ' ' LYS . 35.6 t -60.19 -32.61 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.801 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 13.2 mm-40 -61.97 -57.45 11.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 110.691 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.695 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 38.6 mt -61.69 -43.2 96.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.676 -178.147 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 178' ' ' LEU . 71.8 t -59.64 -49.0 85.35 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.316 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.2 -40.86 99.54 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.314 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 41.2 t -55.85 -42.73 76.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 111.195 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -86.38 -30.49 22.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.873 0.368 . . . . 0.0 111.3 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -63.87 -32.01 73.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.145 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.63 14.64 1.59 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.54 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 43.0 m -147.45 34.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.692 0.282 . . . . 0.0 111.457 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.908 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 72.4 mt -93.31 114.92 64.16 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.752 -0.203 . . . . 0.0 110.613 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.29 127.24 18.69 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.67 2.247 . . . . 0.0 110.892 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 9.0 p -144.61 149.76 16.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.739 -174.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 192' ' ' ASN . . . . . 0.694 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 12.6 m-80 -112.52 155.42 24.34 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.1 tt0 -71.64 -66.68 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -178.042 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -73.49 -43.79 59.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.253 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 195' ' ' ASP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 15.0 t70 -52.64 -48.4 66.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.998 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 36.7 m -71.3 -42.76 68.25 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.338 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 55.0 mt -56.8 -45.94 81.91 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.147 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 18.2 m -62.19 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.906 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 79.4 m -59.8 -49.86 76.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.865 0.364 . . . . 0.0 110.918 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.541 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.6 t80 -60.86 -55.31 34.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.826 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.505 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 76.0 mt -54.35 -50.41 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.669 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -58.34 -43.34 88.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.782 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 -43.82 92.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.488 -179.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 200' ' ' PHE . 17.8 t -73.5 -22.29 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-O 121.34 0.591 . . . . 0.0 110.562 -178.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 9.9 mmm180 . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.138 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.989 0.423 . . . . 0.0 111.64 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.582 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.4 mp0 -57.17 -36.01 70.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.73 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 31.8 t -61.17 -43.04 99.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.224 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.412 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.4 tt -62.75 -46.01 90.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.728 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.573 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.5 t80 -52.88 -59.53 4.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.543 177.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.458 ' HE2' HD11 ' A' ' 201' ' ' ILE . 51.3 m-85 -65.18 -36.21 83.49 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -174.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.47 -45.18 94.21 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 470' ' ' LYS . . . . . 0.434 ' HD2' HD13 ' B' ' 515' ' ' LEU . 23.6 ttmm -67.8 -40.85 83.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.637 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.573 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.2 t -56.21 -48.6 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.903 0.383 . . . . 0.0 110.462 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 472' ' ' ARG . . . . . 0.408 ' O ' ' HD3' ' B' ' 472' ' ' ARG . 1.5 tmt_? -57.07 -45.21 83.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.381 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -76.94 -37.04 56.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.666 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -69.61 -41.08 76.19 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -176.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.13 -32.56 73.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.422 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 40.2 ttt180 69.28 -1.63 2.11 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.875 0.735 . . . . 0.0 111.875 173.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 21.4 t -127.14 131.31 50.79 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.23 -35.66 80.04 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.106 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.01 -37.87 81.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.342 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.24 -37.5 78.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.859 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -68.87 -37.69 79.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.003 0.43 . . . . 0.0 109.907 177.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.9 tt0 -61.37 -42.44 98.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.474 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 1.7 t-20 -52.21 -51.41 58.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.036 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 87.8 t80 -52.71 -47.62 67.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.682 177.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.03 -33.31 75.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.203 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.908 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.8 mtt180 -66.37 -37.74 85.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 176.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 84.1 m -61.18 -36.3 79.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.864 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.541 HD22 ' CG ' ' A' ' 200' ' ' PHE . 62.0 mt -68.89 -45.84 69.93 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.566 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -64.62 -42.31 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.478 -178.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.437 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 17.6 pt -69.18 -32.02 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.608 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.85 -44.3 90.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.079 0.466 . . . . 0.0 109.987 172.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -68.85 -16.68 63.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.831 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -101.37 16.49 25.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.27 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 65.56 10.84 6.99 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.425 0.453 . . . . 0.0 111.647 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.9 t -70.55 -47.22 66.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.915 0.388 . . . . 0.0 110.807 -176.703 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.6 pt -112.07 179.71 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.182 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.0 m -119.8 170.95 8.77 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.057 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.5 ' O ' HG23 ' B' ' 502' ' ' VAL . 55.6 ttp180 -50.57 -56.52 11.37 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.519 0.512 . . . . 0.0 111.384 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.34 -43.65 83.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.336 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 12.4 mm-40 -56.01 -49.0 74.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.362 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.459 ' C ' HD23 ' B' ' 501' ' ' LEU . 8.9 tt -61.64 -46.27 90.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.765 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 498' ' ' ARG . 90.2 t -59.76 -36.69 67.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -82.32 -27.12 32.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.468 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 20.7 mt -65.0 -43.19 93.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.004 0.43 . . . . 0.0 111.528 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.47 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.4 p -84.63 11.51 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.108 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.456 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 32.9 t -59.73 -50.07 88.61 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.158 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.467 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 11.5 Cg_endo -60.56 -8.2 8.56 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.255 1.97 . . . . 0.0 113.308 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.467 ' CE2' ' HG2' ' B' ' 507' ' ' PRO . 65.9 m-85 -110.45 -61.38 1.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.249 -175.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.572 HD22 HD23 ' B' ' 515' ' ' LEU . 74.7 mt -96.93 -14.79 21.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.807 -0.179 . . . . 0.0 111.474 -174.54 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.8 -19.04 64.9 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.668 -176.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -85.73 -3.81 59.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.694 0.283 . . . . 0.0 110.812 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.456 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 74.0 m-85 -122.98 95.11 46.57 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.69 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 513' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 8.2 Cg_endo -51.24 -50.75 12.92 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.21 2.606 . . . . 0.0 113.1 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.73 -39.17 87.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.9 0.381 . . . . 0.0 111.577 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.572 HD23 HD22 ' B' ' 509' ' ' LEU . 14.6 tp -78.13 -41.38 35.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 -173.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -66.96 -39.25 87.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.681 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.84 -36.19 83.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.582 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 8.7 t90 -59.4 -49.03 79.37 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.44 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.3 OUTLIER -62.48 -42.66 99.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.627 -177.186 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -61.96 -40.15 94.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.793 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -63.42 -47.61 81.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.049 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.91 -35.18 79.92 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.01 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.52 -9.23 58.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.657 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.08 41.18 61.04 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.203 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.8 t80 . . . . . 0 C--N 1.322 -0.593 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.887 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 37.7 m . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.507 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 2.6 Cg_exo -75.61 163.37 34.1 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.543 2.162 . . . . 0.0 111.829 176.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -114.78 154.23 28.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.472 -178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.7 p -112.17 135.61 50.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.365 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -101.15 133.65 45.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.155 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.429 ' HB2' HG13 ' A' ' 179' ' ' VAL . 64.7 mt -114.82 3.31 14.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.65 0.738 . . . . 0.0 110.117 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -28.76 40.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.43 -0.804 . . . . 0.0 108.956 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.431 ' HG3' ' N ' ' A' ' 153' ' ' LEU . 3.7 pt20 -59.13 -32.05 69.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.475 175.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.566 HD11 HD21 ' B' ' 504' ' ' LEU . 69.3 mt -69.23 166.83 17.57 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.399 0.619 . . . . 0.0 112.186 -172.578 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -73.57 163.95 27.32 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.406 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.43 -44.8 76.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.278 0.561 . . . . 0.0 109.842 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -64.83 -31.3 72.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.165 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.4 m -60.55 -45.73 92.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.17 0.51 . . . . 0.0 110.797 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 182' ' ' VAL . 87.4 mt -68.91 -38.56 79.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.791 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -63.05 -40.39 97.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.512 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -64.08 -41.58 97.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.272 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -54.02 -52.29 61.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.762 173.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.637 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 22.5 mtpp -67.19 -28.13 67.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.207 -175.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -78.22 -42.57 30.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.681 0.277 . . . . 0.0 111.148 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -77.43 -36.78 52.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.687 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.499 ' CE1' HG22 ' B' ' 490' ' ' ILE . 43.7 m-85 -83.72 -4.21 58.42 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.337 178.257 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 59.03 78.77 0.25 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.625 0.578 . . . . 0.0 111.174 178.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.607 HD12 ' HG2' ' A' ' 162' ' ' LYS . 92.5 mt -115.71 113.19 42.58 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.06 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 15.9 Cg_exo -68.07 135.92 36.27 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.647 2.898 . . . . 0.0 112.057 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.422 ' CG2' HD11 ' A' ' 173' ' ' LEU . 3.7 t . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.652 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.422 HD11 ' CG2' ' A' ' 169' ' ' THR . 86.5 mt . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.854 0.359 . . . . 0.0 110.56 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.443 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 88.4 m-20 -113.59 178.03 4.42 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.256 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.696 ' O ' HG23 ' A' ' 179' ' ' VAL . 55.4 tptt -46.05 -57.91 4.05 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.879 0.737 . . . . 0.0 112.166 -177.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 176' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -54.52 -49.63 69.76 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -176.069 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.1 -43.02 91.84 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.017 0.437 . . . . 0.0 110.594 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 94.8 mt -61.81 -48.85 78.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.022 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 175' ' ' LYS . 13.6 t -58.66 -42.6 85.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.501 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 19.3 mm-40 -58.28 -49.74 76.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.651 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.637 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 79.6 mt -65.4 -48.48 82.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.068 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.1 t -59.28 -45.76 92.88 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.959 -177.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.16 -39.91 94.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.374 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.4 t -59.22 -40.49 86.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.755 0.312 . . . . 0.0 110.726 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -87.25 -26.43 23.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.776 0.322 . . . . 0.0 111.089 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.58 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 27.4 t80 -60.9 -44.02 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.008 0.523 . . . . 0.0 111.136 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -79.94 21.64 0.55 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.06 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 45.5 m -145.77 28.75 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.816 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.642 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 73.2 mt -90.1 125.38 60.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.666 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.47 140.3 51.97 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.837 2.358 . . . . 0.0 110.973 172.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.614 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.0 p -153.05 134.74 5.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.16 0.505 . . . . 0.0 110.925 -174.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -102.78 109.17 20.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.599 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 40.1 tt0 -47.89 -62.56 1.4 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -169.05 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -65.37 -45.13 85.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.504 0.192 . . . . 0.0 111.494 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.68 -43.26 99.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.601 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 89.7 m -65.2 -37.16 86.44 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.039 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 22.1 mt -60.99 -47.27 87.23 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.4 m -59.17 -46.06 89.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.354 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 69.3 m -61.15 -51.22 69.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.346 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.599 ' CD1' HD22 ' B' ' 488' ' ' LEU . 45.8 t80 -56.24 -55.99 26.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.291 -178.14 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.599 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 74.9 mt -55.72 -48.86 77.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.21 -42.07 98.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.845 -177.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.4 m -62.95 -42.77 99.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.414 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 200' ' ' PHE . 56.6 t -68.84 -28.09 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.04 0.448 . . . . 0.0 110.736 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.599 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 14.2 mmm-85 . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.538 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 463' ' ' THR . . . . . 0.428 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 120.807 0.337 . . . . 0.0 111.707 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.48 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.1 mp0 -63.33 -40.84 98.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.127 177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.1 m -68.06 -29.84 68.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.229 176.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' B' ' 463' ' ' THR . 54.4 tp -64.91 -46.22 82.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.745 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.503 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.8 t80 -52.59 -58.88 5.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.61 175.194 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.549 ' HE2' HD11 ' A' ' 201' ' ' ILE . 59.3 m-85 -62.62 -32.07 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.76 -45.27 90.58 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.032 0.444 . . . . 0.0 110.393 176.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -63.39 -43.44 97.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.421 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.0 t -57.63 -43.72 84.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.068 0.461 . . . . 0.0 110.444 177.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -56.74 -50.9 70.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.552 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -77.29 -24.59 50.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.607 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -78.45 -42.1 30.89 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.71 -44.94 22.36 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.998 -177.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 70.06 -55.49 0.6 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.912 0.757 . . . . 0.0 111.927 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 8.8 t -63.74 125.97 26.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.438 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.62 -46.16 84.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.312 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -31.27 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.36 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.86 -41.87 64.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.988 0.423 . . . . 0.0 110.942 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.54 -37.54 77.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.246 0.546 . . . . 0.0 109.748 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 28.8 tt0 -64.29 -38.57 91.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.405 175.5 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.442 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.9 t30 -58.03 -44.57 87.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.873 176.531 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -55.98 -45.79 78.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.166 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.614 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.7 mt -67.79 -29.13 68.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.227 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.686 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -62.99 -43.19 99.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.918 0.389 . . . . 0.0 110.101 173.62 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.63 -35.82 78.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.266 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.599 HD22 ' CD1' ' A' ' 200' ' ' PHE . 25.0 mt -66.52 -52.08 49.72 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.265 179.376 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 11.2 m -61.06 -41.91 91.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.563 HD13 ' HE1' ' A' ' 186' ' ' PHE . 18.7 pt -69.7 -27.49 33.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.838 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -67.89 -39.1 83.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 109.841 172.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -72.48 -35.28 68.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.261 -177.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.06 18.65 3.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.528 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 56.26 49.11 15.89 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.162 0.506 . . . . 0.0 111.463 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 75.7 t -103.43 -49.26 10.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.582 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 44.8 pt -112.24 172.16 3.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.917 0.389 . . . . 0.0 110.966 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.409 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 18.9 p -109.43 179.73 4.06 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.786 176.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.521 ' O ' HG23 ' B' ' 502' ' ' VAL . 57.9 ttp180 -59.85 -47.83 84.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.775 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.76 70.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.784 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.474 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 5.4 mm-40 -56.36 -46.03 80.2 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.158 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.408 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 63.6 tp -58.31 -48.62 79.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.43 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.546 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 67.1 t -65.65 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.16 -177.463 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -77.04 -30.69 55.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -176.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.566 HD21 HD11 ' A' ' 153' ' ' LEU . 44.3 mt -66.73 -41.62 87.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.984 0.421 . . . . 0.0 111.78 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -86.94 10.41 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.353 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.672 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 78.2 p -64.77 -44.2 72.18 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.672 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 24.1 Cg_exo -67.46 -8.53 22.45 Favored 'Trans proline' 0 C--N 1.358 1.068 0 C-N-CA 122.086 1.858 . . . . 0.0 111.977 176.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -99.92 -67.9 0.83 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.753 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.612 HD22 HD23 ' B' ' 515' ' ' LEU . 67.0 mt -96.22 -8.1 33.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.438 -173.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.68 -16.31 61.01 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 121.093 -0.575 . . . . 0.0 113.043 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.592 ' HE3' ' O ' ' B' ' 507' ' ' PRO . 0.0 OUTLIER -87.76 -2.91 58.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.932 0.396 . . . . 0.0 110.518 178.184 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -117.77 96.78 50.02 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.732 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.52 -52.5 8.75 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.195 2.596 . . . . 0.0 112.879 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.21 -39.82 87.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.905 0.383 . . . . 0.0 111.461 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.612 HD23 HD22 ' B' ' 509' ' ' LEU . 25.4 tp -79.8 -44.1 21.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.957 -172.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.404 ' CD2' ' HE3' ' B' ' 520' ' ' LYS . 8.7 t80 -69.02 -32.98 72.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.284 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -73.77 -35.37 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.125 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.48 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 11.5 t90 -56.38 -48.82 76.08 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 173.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.546 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 21.6 t80 -55.92 -45.93 78.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.678 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' B' ' 516' ' ' PHE . 99.0 mttt -59.71 -47.93 83.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.107 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -62.21 -41.92 98.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -177.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -64.75 -35.54 81.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.052 0.453 . . . . 0.0 110.694 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.48 -7.15 57.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.172 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 68.41 26.82 74.09 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.969 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 85.4 t80 . . . . . 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 110.531 -176.278 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 97.9 m . . . . . 0 C--O 1.233 0.186 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.17 143.03 82.76 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.241 1.96 . . . . 0.0 111.748 176.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -98.66 118.99 36.62 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.148 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.0 p -81.97 123.66 38.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.304 0.574 . . . . 0.0 110.792 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -89.39 131.26 35.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.177 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.465 ' HB2' HG13 ' A' ' 179' ' ' VAL . 96.8 mt -111.21 6.38 20.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.242 0.544 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -81.66 -26.73 34.51 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.559 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 28.0 pt20 -67.79 -22.51 65.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.578 175.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.628 HD21 HD21 ' B' ' 504' ' ' LEU . 30.8 mt -67.26 151.14 48.04 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 154' ' ' GLN . . . . . 0.488 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 50.9 mt-30 -63.83 148.46 49.26 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.528 HG12 ' HE ' ' A' ' 159' ' ' ARG . 48.3 t -56.96 -46.85 84.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.199 0.523 . . . . 0.0 109.892 178.297 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.17 -33.42 74.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.606 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.783 HG21 ' HG2' ' B' ' 500' ' ' GLU . 25.8 m -64.42 -45.67 86.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.897 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.6 mt -64.25 -37.32 87.05 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 110.519 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.528 ' HE ' HG12 ' A' ' 155' ' ' VAL . 74.2 mtt-85 -67.68 -38.13 83.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.53 176.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.6 ttm180 -65.2 -42.88 93.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.061 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.432 ' OH ' HD11 ' A' ' 189' ' ' ILE . 58.0 t80 -53.3 -47.81 68.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.916 173.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.644 ' NZ ' ' HB ' ' A' ' 181' ' ' ILE . 43.6 mttp -61.33 -49.43 77.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.823 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -63.79 -48.1 78.24 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -65.66 -41.77 92.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.91 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -87.0 3.22 46.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.666 -178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 55.74 60.58 3.22 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.043 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 162' ' ' LYS . 85.9 mt -94.45 130.7 32.91 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.957 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.33 125.24 15.85 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.163 1.909 . . . . 0.0 111.423 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.402 HG21 ' HD3' ' A' ' 162' ' ' LYS . 3.2 p . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.938 -177.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 90.9 mt . . . . . 0 C--O 1.233 0.21 0 CA-C-O 121.042 0.449 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.501 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 6.2 m-20 -104.21 164.74 11.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.529 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' A' ' 155' ' ' VAL . 5.8 tmtt? -56.33 -50.08 72.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.667 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.95 85.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.427 ' HA ' ' HG2' ' A' ' 180' ' ' GLU . 10.2 mm-40 -61.63 -41.71 97.87 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.555 0.693 . . . . 0.0 110.249 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 98.7 mt -61.85 -52.06 65.69 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.883 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.465 HG13 ' HB2' ' A' ' 150' ' ' LEU . 78.5 t -58.24 -48.99 83.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 O-C-N 123.614 0.571 . . . . 0.0 111.626 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.549 ' HG3' ' N ' ' A' ' 181' ' ' ILE . 6.7 pt-20 -62.02 -46.19 90.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.44 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.644 ' HB ' ' NZ ' ' A' ' 162' ' ' LYS . 80.6 mt -70.95 -39.27 74.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 120.622 0.249 . . . . 0.0 110.916 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 54.6 t -64.66 -47.55 88.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.94 -41.16 98.77 Favored Glycine 0 N--CA 1.449 -0.482 0 O-C-N 123.454 0.471 . . . . 0.0 112.432 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.7 t -59.19 -45.14 91.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.891 0.377 . . . . 0.0 110.544 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -78.27 -29.76 48.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.538 ' HE1' HD13 ' B' ' 490' ' ' ILE . 15.3 t80 -60.83 -39.02 87.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.683 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -75.78 6.6 4.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 p -128.88 21.09 5.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.922 0.392 . . . . 0.0 111.248 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.726 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.3 mt -88.85 118.35 69.2 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.417 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 190' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 5.3 Cg_exo -78.22 137.74 15.44 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.003 2.469 . . . . 0.0 111.569 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.506 HG11 ' HB3' ' B' ' 485' ' ' LEU . 0.0 OUTLIER -124.77 167.18 19.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.21 0.528 . . . . 0.0 111.786 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -125.28 110.38 13.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.684 174.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -48.36 -59.82 3.16 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.392 0.433 . . . . 0.0 111.766 -172.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -55.55 -57.37 12.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.68 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.43 -48.37 79.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.602 -173.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.1 m -63.59 -41.14 98.38 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.541 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 68.8 mt -65.17 -43.22 92.42 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.193 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.1 m -59.26 -41.09 87.98 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.699 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 91.7 m -58.36 -55.99 27.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 176.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.524 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 60.6 t80 -57.53 -50.81 71.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.399 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.482 HD11 ' HE2' ' B' ' 468' ' ' PHE . 63.9 mt -57.36 -55.13 22.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.766 -175.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.48 -32.74 70.39 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.0 m -70.45 -45.97 64.73 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.218 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.1 -27.96 20.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.974 0.416 . . . . 0.0 111.158 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.188 177.543 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.497 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.466 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.6 mp0 -58.56 -43.77 89.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.598 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 6.8 m -59.29 -44.07 92.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.028 0.442 . . . . 0.0 110.441 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.08 -49.83 76.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.815 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.4 t80 -53.03 -55.87 20.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.6 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.524 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 29.9 m-85 -63.92 -34.25 77.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.42 -43.65 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.542 -0.463 . . . . 0.0 109.985 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.56 -45.28 93.64 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 175.786 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.513 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -57.31 -49.41 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.987 0.422 . . . . 0.0 110.383 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -62.68 -38.41 90.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.838 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 tptp -80.35 -33.01 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.521 -174.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -80.56 -46.25 16.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.319 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.1 -46.66 87.73 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.7 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 51.1 mtt85 71.55 -49.24 0.68 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.74 0.65 . . . . 0.0 112.705 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.0 t -66.21 129.45 39.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.711 -178.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.34 70.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.727 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -75.55 -22.5 56.99 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.835 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -66.28 -51.41 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.133 0.492 . . . . 0.0 110.117 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' B' ' 485' ' ' LEU . 90.5 t80 -63.37 -40.64 97.8 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.945 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.572 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 38.1 tt0 -60.76 -42.78 98.11 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.865 177.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.418 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 6.9 t30 -59.38 -39.9 84.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.6 -45.95 81.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.389 0.614 . . . . 0.0 109.915 172.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.506 ' HB3' HG11 ' A' ' 191' ' ' VAL . 83.5 mt -67.02 -33.19 75.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.362 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.0 OUTLIER -57.75 -45.79 85.41 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.224 0.535 . . . . 0.0 109.867 174.132 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 36.4 m -59.69 -38.93 82.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.401 176.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.9 mt -65.34 -49.31 69.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 10.8 m -63.76 -42.89 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.665 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.538 HD13 ' HE1' ' A' ' 186' ' ' PHE . 26.5 pt -69.89 -28.53 37.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.874 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -67.61 -43.05 81.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.172 0.511 . . . . 0.0 110.344 174.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -79.49 -16.21 56.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.791 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -98.64 21.26 11.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.361 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 65.84 25.74 11.23 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.404 0.44 . . . . 0.0 112.103 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.569 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 89.2 t -92.25 -56.19 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.755 0.312 . . . . 0.0 110.663 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 32.8 pt -111.04 162.48 8.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.726 0.298 . . . . 0.0 110.289 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 8.9 t -105.82 -175.24 2.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.13 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.543 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.3 ttm180 -55.85 -51.65 66.77 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.677 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 499' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -50.46 -50.81 51.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.892 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.783 ' HG2' HG21 ' A' ' 157' ' ' THR . 3.8 mp0 -60.47 -45.17 94.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.939 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.615 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 64.9 tp -57.32 -46.0 83.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.029 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.784 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 54.5 t -64.54 -38.01 81.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.954 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.559 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 48.6 mt-30 -71.37 -42.48 68.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.912 -177.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.628 HD21 HD21 ' A' ' 153' ' ' LEU . 76.5 mt -63.33 -40.86 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.603 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.7 p -86.63 4.49 3.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.982 0.42 . . . . 0.0 111.262 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 24.0 t -59.0 -52.44 74.77 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.751 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' B' ' 506' ' ' SER . 10.8 Cg_endo -57.75 -18.35 33.5 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 122.082 1.854 . . . . 0.0 113.154 176.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.71 -52.0 5.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.603 ' HG ' HG22 ' B' ' 505' ' ' VAL . 62.4 mt -97.71 -11.72 23.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.536 -174.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.56 -14.04 64.14 Favored Glycine 0 C--O 1.23 -0.136 0 C-N-CA 121.391 -0.433 . . . . 0.0 112.875 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 53.1 mttm -77.22 -15.51 59.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.271 0.557 . . . . 0.0 109.659 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -124.08 96.89 41.55 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.247 -176.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -49.58 -48.3 19.56 Favored 'Trans proline' 0 CA--C 1.529 0.253 0 C-N-CA 123.234 2.622 . . . . 0.0 113.504 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -66.94 -40.6 87.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.985 0.421 . . . . 0.0 111.088 -177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 18.5 tp -69.23 -44.84 71.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.523 -175.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -68.31 -32.88 73.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.087 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -63.5 -43.0 98.48 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.466 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 12.4 t90 -57.28 -49.06 77.26 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.846 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.784 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 66.9 t80 -59.04 -46.72 87.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.145 -178.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -64.17 -36.25 83.46 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.968 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -72.01 -37.42 69.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.108 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -66.87 -34.35 77.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.28 0.562 . . . . 0.0 110.583 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.484 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 9.0 mp -83.93 -14.65 50.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.038 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.97 35.82 61.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.139 -174.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 79.1 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.253 -0.473 . . . . 0.0 110.468 -177.657 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.9 m . . . . . 0 C--O 1.236 0.365 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -57.91 133.26 54.74 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.367 2.044 . . . . 0.0 111.296 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.42 110.09 6.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.302 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -73.7 110.36 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.572 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.573 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 18.9 t0 -72.38 88.15 1.18 Allowed 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.555 HD23 HD22 ' B' ' 504' ' ' LEU . 95.7 mt -89.57 -8.06 53.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.818 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -82.69 -23.06 34.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.865 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 4.7 pt20 -74.2 -18.94 60.69 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.86 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.3 mt -65.79 155.27 36.71 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.742 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -71.26 158.93 35.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.159 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.411 HG13 ' CD1' ' A' ' 178' ' ' LEU . 16.6 t -60.67 -46.32 96.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 109.972 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ASN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 159' ' ' ARG . 84.7 m-20 -67.71 -21.34 65.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.733 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.3 m -69.5 -51.32 36.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.183 0.516 . . . . 0.0 110.468 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 30.7 mt -65.96 -32.58 74.16 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 122.034 0.921 . . . . 0.0 109.57 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.545 ' HB3' ' HA ' ' A' ' 156' ' ' ASN . 77.8 ttt180 -63.08 -43.37 98.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.581 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 17.8 ttm180 -69.5 -37.73 77.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.543 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.463 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 70.9 t80 -51.53 -57.37 9.25 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.605 0.24 . . . . 0.0 110.7 174.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 7.1 ptpp? -66.96 -27.02 67.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.794 0.33 . . . . 0.0 111.13 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -69.43 -47.95 62.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.777 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -71.93 -45.44 61.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.042 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.431 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 70.8 m-85 -81.74 1.91 32.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.331 -177.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 57.4 74.47 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.25 176.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.68 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 90.0 mt -111.45 106.86 57.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.944 177.734 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.473 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -58.63 126.02 20.04 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.305 2.003 . . . . 0.0 111.39 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.65 ' HB ' HD11 ' A' ' 173' ' ' LEU . 3.1 p . . . . . 0 C--N 1.32 -0.698 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.125 -176.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.65 HD11 ' HB ' ' A' ' 169' ' ' THR . 95.8 mt . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 121.019 0.438 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.654 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 18.0 m120 -102.04 169.59 8.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.999 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.5 tptm -59.87 -54.24 48.5 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.317 -178.142 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.79 -33.39 72.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.982 0.42 . . . . 0.0 110.66 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.654 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 85.4 mm-40 -62.0 -45.06 95.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.304 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 62.7 mt -59.14 -47.49 85.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.518 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 175' ' ' LYS . 18.3 t -59.29 -45.05 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.072 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -61.64 -46.13 91.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.17 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 86.8 mt -58.49 -45.84 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-O 121.165 0.507 . . . . 0.0 110.426 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.569 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 70.3 t -62.22 -48.63 87.52 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.991 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -65.02 -38.89 95.97 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.384 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 48.2 t -59.03 -43.29 91.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.801 0.334 . . . . 0.0 110.811 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -84.47 -23.23 29.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 110.951 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.569 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 20.7 t80 -64.41 -41.62 96.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.799 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -70.62 -18.35 62.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.677 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 14.9 p -106.5 27.41 8.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.636 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.9 mt -89.9 114.07 59.4 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.547 0.213 . . . . 0.0 110.448 175.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -68.49 103.92 1.03 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.436 2.091 . . . . 0.0 111.663 177.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.63 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.9 p -110.47 156.85 11.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -127.81 126.23 41.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.4 tt0 -50.9 -59.71 3.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.92 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.91 -57.16 13.83 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.62 -39.59 84.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 -171.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 95.6 m -67.58 -38.63 84.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.611 -178.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 39.6 mt -63.41 -46.11 87.9 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 174.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.6 m -59.09 -40.55 85.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.535 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 21.1 m -57.56 -55.79 30.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.248 177.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.552 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.5 t80 -62.09 -51.58 67.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.235 -175.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.55 -48.88 85.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.78 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -71.43 -31.2 66.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.081 -174.625 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.5 m -72.7 -53.97 10.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.198 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.518 HG11 HD23 ' B' ' 523' ' ' LEU . 54.4 t -65.29 -36.09 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.658 -174.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 111.079 177.18 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -64.16 -47.91 78.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.663 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.2 m -60.77 -35.11 75.61 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.241 177.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 35.9 tp -63.08 -52.33 63.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.153 176.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.8 t80 -52.54 -57.89 8.53 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.95 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.401 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.8 m-85 -64.39 -34.53 78.38 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.089 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.4 -40.63 96.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.252 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.1 mttt -68.27 -34.92 77.06 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.696 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -63.1 -42.92 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.073 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.24 92.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.441 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -74.35 -36.55 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.185 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.574 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -66.6 -48.95 67.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.69 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 475' ' ' LEU . . . . . 0.435 HD23 ' O ' ' B' ' 480' ' ' ALA . 10.3 mp -71.43 -37.15 71.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.026 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 71.89 -60.83 0.51 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 124.134 0.896 . . . . 0.0 112.642 170.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 45.4 m -67.51 139.45 56.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.945 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -58.03 -44.72 87.51 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.06 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -65.12 -39.11 92.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.557 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.435 ' O ' HD23 ' B' ' 475' ' ' LEU . . . -62.09 -51.57 67.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.871 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -65.84 -36.94 84.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.215 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.684 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 30.3 tt0 -59.44 -42.13 91.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 175.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.65 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.1 t30 -60.8 -43.29 98.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.98 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.8 -45.19 70.7 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.325 0.583 . . . . 0.0 110.359 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 191' ' ' VAL . 86.2 mt -67.53 -31.81 72.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.466 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.684 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -63.39 -36.91 85.28 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.218 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.1 m -65.14 -36.2 83.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.897 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.552 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.3 mt -65.25 -48.55 72.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.337 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 13.9 m -65.04 -42.26 94.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.828 -177.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 186' ' ' PHE . 38.7 pt -69.15 -30.74 47.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.169 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -68.37 -45.01 73.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.111 0.481 . . . . 0.0 110.242 173.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -62.24 -38.8 90.61 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.991 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -86.31 16.28 4.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.698 -176.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 494' ' ' GLU . . . . . 0.427 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 0.1 OUTLIER 63.08 38.95 10.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.985 0.421 . . . . 0.0 111.045 174.926 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.581 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.9 t -96.7 -33.71 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.255 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 39.0 pt -124.73 153.32 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.929 0.395 . . . . 0.0 111.212 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 46.2 m -80.02 166.23 21.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.019 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.524 ' O ' HG23 ' B' ' 502' ' ' VAL . 20.7 ttm180 -54.92 -53.98 48.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.765 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.56 85.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.823 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.0 mm-40 -55.48 -46.29 76.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.67 -51.12 71.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.038 0.447 . . . . 0.0 110.99 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 498' ' ' ARG . 59.9 t -60.09 -35.44 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.667 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -67.42 -42.25 83.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.91 178.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.555 HD22 HD23 ' A' ' 150' ' ' LEU . 93.8 mt -66.77 -39.91 88.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 111.508 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.431 HG11 ' CE2' ' B' ' 519' ' ' PHE . 4.6 p -85.14 2.43 4.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.035 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.704 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 14.2 t -58.49 -53.84 62.1 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.357 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 31.8 Cg_exo -61.83 -26.66 79.57 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.744 1.629 . . . . 0.0 112.143 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -73.93 -60.59 2.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.575 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.575 HD22 HD23 ' B' ' 515' ' ' LEU . 78.8 mt -102.28 -10.39 19.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -172.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.21 -21.76 64.43 Favored Glycine 0 C--O 1.229 -0.166 0 C-N-CA 121.229 -0.51 . . . . 0.0 113.312 -176.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -81.98 0.95 37.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.079 0.466 . . . . 0.0 110.79 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.574 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 50.2 m-85 -125.58 90.29 50.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 174.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 -45.7 27.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.484 2.79 . . . . 0.0 113.602 -174.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.29 -45.23 73.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.975 0.417 . . . . 0.0 110.659 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.575 HD23 HD22 ' B' ' 509' ' ' LEU . 15.5 tp -67.89 -43.13 80.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.635 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 25.8 t80 -67.29 -38.84 85.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.446 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.69 -37.78 85.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.491 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.61 -49.3 75.35 Favored 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.431 ' CE2' HG11 ' B' ' 505' ' ' VAL . 66.0 t80 -58.86 -45.9 89.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.859 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.429 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 58.3 mtpt -62.95 -42.71 99.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.874 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 521' ' ' ASN . . . . . 0.409 HD22 ' C ' ' B' ' 521' ' ' ASN . 0.2 OUTLIER -66.44 -35.5 80.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.988 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.21 -42.72 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.346 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.518 HD23 HG11 ' A' ' 204' ' ' VAL . 81.8 mt -78.21 -14.96 59.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.374 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 78.15 15.98 80.33 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.345 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 61.2 t80 . . . . . 0 C--N 1.325 -0.485 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.61 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.3 m . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -73.72 155.63 49.17 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.534 2.156 . . . . 0.0 111.159 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -123.02 145.93 48.09 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.772 0.32 . . . . 0.0 111.256 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.87 125.23 51.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.91 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.438 ' HB2' ' OE1' ' A' ' 152' ' ' GLN . 11.0 m-20 -72.96 -30.49 63.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.687 -174.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.439 HD23 HD22 ' B' ' 504' ' ' LEU . 64.8 mt 60.5 7.16 1.26 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.114 -176.625 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -75.14 -26.42 59.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.457 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.6 OUTLIER -61.59 -17.87 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.076 -177.536 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.591 ' O ' ' HB ' ' A' ' 157' ' ' THR . 28.1 mt -80.42 4.6 17.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 154' ' ' GLN . . . . . 0.607 ' HA ' ' HE2' ' A' ' 175' ' ' LYS . 21.0 mm-40 55.61 -170.79 0.07 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.782 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.609 HG12 HD12 ' A' ' 178' ' ' LEU . 1.6 m -77.85 -37.64 23.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 121.632 -0.667 . . . . 0.0 110.776 172.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -58.21 -53.69 55.43 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' A' ' 153' ' ' LEU . 41.9 m -70.57 -34.68 72.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.641 0.258 . . . . 0.0 111.388 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 82.8 mt -63.06 -40.18 96.92 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.351 0.596 . . . . 0.0 110.523 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.2 mtt180 -69.88 -31.4 69.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.815 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 29.4 ttm180 -68.27 -42.37 79.65 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -52.05 -51.25 58.72 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.451 ' NZ ' HG23 ' A' ' 182' ' ' VAL . 54.4 mttp -61.01 -43.65 98.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.745 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -70.38 -38.87 74.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.29 -175.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -79.53 -35.52 39.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -176.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 59.3 m-85 -92.75 1.69 57.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 59.34 79.89 0.21 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.804 0.69 . . . . 0.0 111.38 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.439 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 96.8 mt -120.17 100.37 47.93 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.92 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -61.59 125.65 17.23 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.382 2.055 . . . . 0.0 111.657 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.883 -175.694 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.073 0.463 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.599 ' HB3' ' HG2' ' A' ' 177' ' ' GLN . 56.5 t30 -142.0 165.5 27.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.257 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 154' ' ' GLN . 27.2 tptp -50.22 -54.85 18.14 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 122.84 0.456 . . . . 0.0 111.546 -178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.49 93.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.332 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.599 ' HG2' ' HB3' ' A' ' 174' ' ' ASN . 8.6 mm100 -64.42 -38.56 91.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.54 0.686 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.609 HD12 HG12 ' A' ' 155' ' ' VAL . 96.6 mt -61.9 -44.86 95.93 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.929 176.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.27 -50.34 80.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 O-C-N 123.58 0.55 . . . . 0.0 111.36 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -56.41 -53.71 54.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.619 0.247 . . . . 0.0 111.476 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 64.1 mt -62.63 -40.71 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-O 120.714 0.292 . . . . 0.0 111.036 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.451 HG23 ' NZ ' ' A' ' 162' ' ' LYS . 39.2 t -64.64 -47.82 87.32 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.22 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.32 -36.28 92.84 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.349 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.2 t -58.63 -47.4 84.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.317 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -80.13 -28.44 38.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -61.0 -47.68 85.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.137 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -74.53 -3.66 32.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -106.94 17.29 23.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.991 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.675 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.4 mt -87.98 117.74 68.82 Favored Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.881 178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 190' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 3.3 Cg_exo -74.64 100.07 1.29 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.863 2.375 . . . . 0.0 111.0 175.279 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.445 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 13.3 p -115.46 135.2 56.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.061 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -108.05 125.72 51.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.027 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.465 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.0 tt0 -50.97 -59.71 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 123.63 0.581 . . . . 0.0 112.39 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -51.8 -58.21 7.09 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.656 0.614 . . . . 0.0 112.656 -173.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.02 -41.5 97.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.084 -176.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 54.7 m -65.92 -42.85 89.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 201' ' ' ILE . 53.1 mt -59.46 -43.84 93.11 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 41.8 m -59.5 -48.41 81.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.771 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.96 -49.15 78.94 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.788 0.328 . . . . 0.0 110.626 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' B' ' 488' ' ' LEU . 46.2 t80 -59.35 -60.39 3.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.699 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.511 HD11 ' HE2' ' B' ' 468' ' ' PHE . 46.9 mt -58.11 -44.7 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.002 0.43 . . . . 0.0 110.497 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -61.87 -41.21 97.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.966 -178.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -63.56 -51.67 64.39 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.801 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.3 t -65.69 -28.8 45.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.226 -175.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 . . . . . 0 C--O 1.234 0.256 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.615 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.8 p . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.062 0.458 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.16 -42.84 91.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.791 176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 5.8 t -64.15 -35.74 81.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.284 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.36 -44.44 96.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.099 177.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.543 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.3 t80 -53.24 -55.02 27.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.511 ' HE2' HD11 ' A' ' 201' ' ' ILE . 63.5 m-85 -65.49 -32.35 73.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.13 -40.51 97.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.531 . . . . 0.0 110.253 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -68.19 -44.12 76.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.537 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.543 HG23 ' O ' ' B' ' 467' ' ' PHE . 59.8 t -55.12 -43.64 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.188 0.518 . . . . 0.0 110.052 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 28.9 mtt-85 -57.09 -53.0 63.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.799 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -73.28 -33.63 65.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.729 -174.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.572 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -73.62 -47.93 36.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.773 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.8 mp -69.26 -34.45 74.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.791 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 71.65 -40.54 0.48 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.937 0.773 . . . . 0.0 112.298 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 22.8 t -83.97 127.98 34.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.829 0.347 . . . . 0.0 110.387 -175.314 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.93 -46.51 84.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.664 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.21 -24.91 61.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.07 -176.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.86 -42.02 81.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.129 0.49 . . . . 0.0 109.826 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -66.69 -35.58 80.48 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 41.6 tt0 -62.52 -43.07 99.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.231 175.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.3 -45.87 72.66 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.628 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.559 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 82.3 t80 -54.98 -49.05 72.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.3 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 193' ' ' GLU . 89.1 mt -63.94 -34.47 78.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.548 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.675 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.5 mtt180 -67.66 -36.8 81.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.101 0.477 . . . . 0.0 110.349 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.53 -34.03 76.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.707 174.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 200' ' ' PHE . 50.5 mt -68.04 -44.2 76.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.412 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.477 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.8 m -66.72 -42.87 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.401 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.433 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 19.3 pt -69.66 -26.79 31.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.752 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -67.88 -39.33 83.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.102 0.477 . . . . 0.0 110.149 173.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -71.69 -26.12 62.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.965 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -93.6 18.07 10.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 64.78 14.58 9.25 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.562 0.538 . . . . 0.0 111.762 176.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.548 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 62.0 t -76.37 -41.5 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.852 0.358 . . . . 0.0 110.355 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.44 HG22 ' CG2' ' A' ' 157' ' ' THR . 37.1 pt -122.39 169.63 13.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.975 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 9.0 t -121.01 -176.0 3.17 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.618 ' HG3' ' HB3' ' B' ' 523' ' ' LEU . 22.9 ttm180 -57.53 -48.13 80.13 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.164 0.29 . . . . 0.0 111.639 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 499' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -56.79 -54.55 45.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.742 -174.119 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 1.7 pm0 -69.69 -32.49 71.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.522 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 61.5 tp -58.32 -49.71 76.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.807 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 99.3 t -64.07 -39.81 86.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.676 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.457 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 98.4 mt-30 -71.3 -24.96 62.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.093 -178.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 79.7 mt -70.46 -40.46 73.7 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.154 -0.341 . . . . 0.0 111.233 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.528 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.5 p -91.16 5.33 5.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 110.552 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.558 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 9.5 t -58.41 -48.64 96.59 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.345 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.7 Cg_exo -61.93 -9.3 13.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 122.353 2.036 . . . . 0.0 112.998 176.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -107.25 -60.03 1.74 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.252 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.528 ' HG ' HG22 ' B' ' 505' ' ' VAL . 82.6 mt -90.25 -12.75 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.943 -175.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -68.03 -7.07 48.82 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.706 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 52.1 mttm -84.92 -17.35 38.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.236 0.541 . . . . 0.0 109.739 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.572 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 51.2 m-85 -122.48 97.93 44.23 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.136 -175.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.6 -52.18 9.46 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 123.437 2.758 . . . . 0.0 113.596 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -66.85 -30.78 71.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 111.3 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 29.6 tp -78.09 -43.78 28.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.189 0.519 . . . . 0.0 109.988 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 9.2 t80 -67.8 -31.86 72.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.719 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -66.86 -42.92 84.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.794 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -54.18 -49.79 68.51 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.807 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 73.5 t80 -58.78 -59.48 5.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.87 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -57.0 -40.21 76.17 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -176.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -62.84 -37.7 87.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.937 0.399 . . . . 0.0 110.653 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -67.83 -47.23 69.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.902 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.618 ' HB3' ' HG3' ' B' ' 498' ' ' ARG . 3.8 mm? -70.57 -17.4 62.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.887 -177.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.91 32.59 12.44 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.382 -175.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 21.3 t80 . . . . . 0 C--N 1.324 -0.542 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.835 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 98.9 m . . . . . 0 C--O 1.234 0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 26.7 Cg_exo -62.32 136.49 60.0 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.444 2.096 . . . . 0.0 111.285 177.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -95.86 133.67 39.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.245 0.545 . . . . 0.0 111.856 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 p -92.75 102.97 14.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.457 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.61 117.93 13.79 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.54 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.45 1.9 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.13 0.49 . . . . 0.0 110.764 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -80.37 -26.99 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.729 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.621 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 6.1 pt20 -67.45 -20.91 65.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.153 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.554 HD11 HD21 ' B' ' 504' ' ' LEU . 73.0 mt -72.11 165.81 23.58 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.368 0.604 . . . . 0.0 112.182 -174.214 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 154' ' ' GLN . . . . . 0.55 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 98.3 mt-30 -72.2 154.15 41.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.552 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.1 t -63.12 -46.01 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.029 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -61.48 -33.15 73.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.631 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.55 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 48.2 m -61.93 -50.92 70.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.012 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.3 -39.4 93.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.126 0.489 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -67.96 -30.39 69.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.765 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.555 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.9 ttm180 -70.4 -40.86 73.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.57 ' HA ' HG13 ' B' ' 495' ' ' VAL . 61.6 t80 -57.03 -52.25 66.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.27 173.576 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.57 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.2 mtpm? -59.63 -33.62 71.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.992 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -78.19 -42.96 29.89 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.769 0.319 . . . . 0.0 111.232 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -67.07 -42.42 84.74 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -178.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -92.47 -1.38 57.02 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm 58.2 79.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.504 0.503 . . . . 0.0 111.597 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.735 HD23 HG22 ' A' ' 181' ' ' ILE . 11.0 mp -103.27 120.02 53.33 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.76 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 12.9 Cg_exo -68.97 129.71 18.94 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 123.572 2.848 . . . . 0.0 112.464 -175.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.448 HG21 HD11 ' A' ' 173' ' ' LEU . 8.9 t . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.925 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.448 HD11 HG21 ' A' ' 169' ' ' THR . 81.9 mt . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.622 0.248 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.453 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 31.5 m-80 -85.43 177.9 7.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.612 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.635 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.9 tptm -57.8 -52.59 64.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.388 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.8 -40.26 79.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 111.159 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -59.56 -48.02 83.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.332 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 91.2 mt -60.49 -48.71 80.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.138 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.2 t -58.8 -46.68 90.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.302 -175.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.29 -39.32 82.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 -177.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.735 HG22 HD23 ' A' ' 167' ' ' LEU . 70.7 mt -67.78 -47.34 80.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 120.805 0.336 . . . . 0.0 110.748 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.62 -47.29 85.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.78 -36.07 92.2 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.563 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 25.0 t -62.58 -39.54 94.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.853 0.359 . . . . 0.0 110.683 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -85.86 -31.75 22.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.765 0.317 . . . . 0.0 110.995 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -63.54 -40.54 97.3 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.843 0.457 . . . . 0.0 112.131 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -74.41 -6.55 48.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 111.55 -177.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 62.8 m -111.89 23.38 13.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.883 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 76.0 mt -84.17 116.04 63.01 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.672 0.272 . . . . 0.0 110.953 177.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 190' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 6.2 Cg_exo -74.41 105.59 2.08 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.073 2.516 . . . . 0.0 110.751 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.8 p -108.65 143.43 18.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.895 0.378 . . . . 0.0 111.368 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -110.78 113.24 25.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.943 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 47.7 tt0 -46.01 -60.28 2.36 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -60.17 -53.68 54.8 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -63.96 -39.51 94.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.884 0.373 . . . . 0.0 110.834 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 75.4 m -64.74 -43.73 92.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 -178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 63.6 mt -60.82 -45.06 95.9 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -56.91 -47.0 81.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.675 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 83.2 m -61.09 -50.78 71.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.417 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.581 ' CD1' HD22 ' B' ' 488' ' ' LEU . 87.1 t80 -60.93 -49.71 76.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.081 -177.485 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.459 HD11 ' HE2' ' B' ' 468' ' ' PHE . 83.9 mt -57.71 -49.95 79.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.382 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -63.27 -33.11 74.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.419 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 42.4 m -69.2 -53.21 21.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.709 0.29 . . . . 0.0 110.715 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 200' ' ' PHE . 15.2 t -66.72 -25.42 34.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.787 0.327 . . . . 0.0 110.987 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.567 176.858 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 463' ' ' THR . . . . . 0.471 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 2.8 p . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.463 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -68.28 -42.82 78.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.221 177.436 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -64.39 -35.53 81.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.022 0.439 . . . . 0.0 110.071 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' B' ' 463' ' ' THR . 18.8 tp -55.13 -53.51 55.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.915 174.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.536 ' CE1' ' HG ' ' B' ' 515' ' ' LEU . 79.4 t80 -54.15 -52.24 61.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.049 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.459 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.1 m-85 -64.79 -34.99 79.66 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.95 -43.12 93.77 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.33 0.586 . . . . 0.0 109.9 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.97 -45.6 94.11 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.146 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 467' ' ' PHE . 94.0 t -58.89 -40.57 80.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.533 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -54.07 -48.28 70.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.262 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 473' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 476' ' ' ARG . 81.8 tttt -82.94 -35.02 26.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -178.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -66.71 -49.2 66.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 475' ' ' LEU . . . . . 0.413 HD13 HG13 ' B' ' 471' ' ' VAL . 8.6 mp -67.47 -34.05 76.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.481 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 476' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' B' ' 473' ' ' LYS . 38.4 mtm180 69.0 -58.1 0.5 Allowed 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.968 0.792 . . . . 0.0 112.377 176.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.0 t -67.54 129.96 41.55 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.849 0.357 . . . . 0.0 110.191 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.22 71.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.496 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.47 -36.62 74.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.111 0.482 . . . . 0.0 109.871 176.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.542 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.41 -45.73 78.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.4 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.416 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 70.5 t80 -65.29 -39.5 92.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.105 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 36.8 tt0 -59.25 -42.68 91.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.243 175.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.62 -43.05 99.57 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -56.4 -45.88 80.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 174.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.473 ' HB3' HG21 ' A' ' 191' ' ' VAL . 93.1 mt -66.12 -33.37 75.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.927 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.883 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 10.7 mtt85 -66.52 -36.7 83.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.052 0.453 . . . . 0.0 110.178 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.2 m -61.21 -37.24 82.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.119 0.485 . . . . 0.0 109.776 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 200' ' ' PHE . 38.6 mt -64.92 -46.99 79.36 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.473 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 17.1 m -64.18 -41.26 91.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.562 -178.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 30.0 pt -69.42 -34.92 64.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.209 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 491' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 501' ' ' LEU . 90.0 t80 -61.65 -47.08 87.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.157 0.503 . . . . 0.0 109.846 172.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -61.38 -35.11 76.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.547 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -87.59 13.98 9.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.512 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.87 24.12 14.37 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 111.121 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.57 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.4 t -76.43 -39.11 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.644 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.616 HD11 HD22 ' B' ' 501' ' ' LEU . 30.9 pt -132.26 158.94 43.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.205 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 3.6 p -94.69 -178.3 4.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.814 0.34 . . . . 0.0 111.792 -176.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.486 ' O ' HG23 ' B' ' 502' ' ' VAL . 41.4 ttp180 -55.67 -55.09 36.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.735 -175.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 499' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -58.67 -39.93 82.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.5 -176.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 6.3 mm-40 -61.61 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.805 0.336 . . . . 0.0 110.385 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 491' ' ' PHE . 0.2 OUTLIER -59.09 -50.58 73.52 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.542 0.687 . . . . 0.0 109.747 177.877 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 498' ' ' ARG . 58.0 t -60.64 -35.19 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.704 -1.135 . . . . 0.0 111.097 -177.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.621 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 75.9 mt-30 -79.15 -35.8 41.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.675 -178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.554 HD21 HD11 ' A' ' 153' ' ' LEU . 67.3 mt -68.19 -38.62 82.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.876 0.37 . . . . 0.0 111.44 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.559 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.6 p -86.26 1.43 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.126 0.489 . . . . 0.0 110.877 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.563 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.2 t -60.54 -47.74 95.38 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.813 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.572 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 32.4 Cg_exo -62.24 -7.08 9.37 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.285 1.99 . . . . 0.0 112.715 175.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -104.15 -58.25 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.833 0.349 . . . . 0.0 110.766 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.559 ' HG ' HG22 ' B' ' 505' ' ' VAL . 80.9 mt -88.49 -2.06 58.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.497 -174.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -65.83 -18.05 65.88 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.08 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 2.5 mptp? -92.21 -2.94 56.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.252 0.549 . . . . 0.0 109.645 178.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -127.55 85.25 61.28 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.853 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.16 -44.51 45.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.174 2.583 . . . . 0.0 112.927 -175.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.63 -46.27 89.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.024 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.536 ' HG ' ' CE1' ' B' ' 467' ' ' PHE . 2.2 tp -69.86 -40.73 75.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.736 -175.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.458 ' CE2' ' HD2' ' B' ' 520' ' ' LYS . 49.6 t80 -66.4 -41.76 88.86 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.2 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -63.23 -45.06 93.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.41 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.463 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 36.7 t90 -56.65 -48.6 77.21 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.145 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.604 ' CZ ' HD12 ' B' ' 501' ' ' LEU . 8.8 t80 -58.43 -47.29 84.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.856 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 50.6 mtpt -61.11 -42.49 98.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.758 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -65.56 -43.84 88.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.257 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.35 -45.51 83.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.89 0.376 . . . . 0.0 110.548 -178.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 89.4 mt -71.15 -26.91 63.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.608 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.78 36.6 8.42 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.668 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.0 t80 . . . . . 0 C--N 1.327 -0.381 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 39.3 m . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.434 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 10.7 Cg_exo -70.19 162.34 42.66 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.392 2.061 . . . . 0.0 111.045 176.14 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -114.67 146.58 40.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.028 0.442 . . . . 0.0 111.422 -175.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.65 124.48 62.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.71 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -88.6 135.37 33.53 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.214 175.291 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.51 HD13 HG12 ' A' ' 182' ' ' VAL . 94.5 mt -114.71 0.63 13.93 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.54 ' HA ' HG21 ' A' ' 179' ' ' VAL . 31.1 t80 -75.78 -25.41 56.41 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -66.67 -24.71 66.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.742 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.596 HD21 HD21 ' B' ' 504' ' ' LEU . 26.0 mt -62.48 147.95 47.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.852 0.358 . . . . 0.0 110.668 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 154' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 158' ' ' LEU . 17.9 mp0 -62.52 145.33 54.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.56 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 178' ' ' LEU . 5.6 p -57.32 -35.58 49.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.588 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -73.26 -33.82 65.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.898 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 34.6 m -65.02 -40.0 94.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.161 0.505 . . . . 0.0 110.07 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 153' ' ' LEU . 29.2 mt -65.71 -38.95 90.63 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.487 0.66 . . . . 0.0 110.02 175.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -62.68 -39.39 93.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.225 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 6.6 ttm180 -68.03 -44.32 76.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.929 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.674 ' HA ' HG13 ' B' ' 495' ' ' VAL . 65.8 t80 -51.77 -57.9 7.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.871 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 158' ' ' LEU . 2.6 ptpp? -68.95 -32.4 71.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.2 -36.65 66.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.967 0.413 . . . . 0.0 110.682 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -76.74 -31.37 57.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.702 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -92.97 -4.46 52.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.767 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 60.71 60.31 1.94 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.154 0.502 . . . . 0.0 111.18 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 89.5 mt -91.53 136.22 26.98 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.061 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 25.7 Cg_exo -61.83 125.4 16.5 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.485 2.123 . . . . 0.0 111.861 -178.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.49 ' HB ' HD11 ' A' ' 173' ' ' LEU . 19.5 p . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.261 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.49 HD11 ' HB ' ' A' ' 169' ' ' THR . 87.2 mt . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 121.275 0.559 . . . . 0.0 111.764 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.587 ' HB3' ' HG3' ' A' ' 177' ' ' GLN . 26.2 t-20 -137.82 157.93 45.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.412 -178.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.471 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.6 tptm -46.57 -52.75 12.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 122.704 0.402 . . . . 0.0 111.07 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.74 -42.23 98.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 174' ' ' ASN . 74.3 mt-30 -63.09 -38.01 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.231 0.539 . . . . 0.0 110.345 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.654 HD12 HG23 ' A' ' 155' ' ' VAL . 89.0 mt -64.13 -41.64 97.14 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.113 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.54 HG21 ' HA ' ' A' ' 151' ' ' TYR . 80.8 t -62.49 -41.25 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 O-C-N 123.782 0.676 . . . . 0.0 111.001 177.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.77 -51.19 70.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.597 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.96 -46.62 96.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.97 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.51 HG12 HD13 ' A' ' 150' ' ' LEU . 65.4 t -62.45 -49.16 84.98 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.434 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.85 97.3 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.372 -0.442 . . . . 0.0 112.534 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.78 -44.2 97.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.699 0.285 . . . . 0.0 110.75 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -82.13 -29.81 31.46 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.104 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -58.89 -41.16 86.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.103 0.477 . . . . 0.0 110.498 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -77.52 9.45 3.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.503 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -131.4 14.88 5.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.528 0.204 . . . . 0.0 111.483 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.641 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 66.5 mt -80.73 119.29 75.75 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 120.69 0.281 . . . . 0.0 110.997 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.61 124.52 9.37 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.859 2.373 . . . . 0.0 111.118 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.584 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.2 p -142.44 128.46 17.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.458 0.647 . . . . 0.0 112.068 -173.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -98.66 127.55 44.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.128 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 41.7 tt0 -54.5 -60.45 3.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 122.751 0.42 . . . . 0.0 112.13 -175.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -55.17 -57.3 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.89 -174.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -60.59 -44.21 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.622 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 94.9 m -66.13 -41.43 90.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.795 -176.232 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 49.2 mt -60.19 -45.7 92.22 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 175.691 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.3 m -61.56 -41.15 96.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.256 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.3 m -62.52 -52.06 64.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.817 178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.566 ' O ' HG23 ' A' ' 204' ' ' VAL . 71.2 t80 -57.98 -57.78 11.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.002 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.606 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 78.6 mt -54.46 -55.16 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -56.8 -40.27 75.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.092 -175.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.9 m -67.44 -48.86 66.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.482 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 200' ' ' PHE . 11.7 t -69.87 -22.55 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 120.936 0.398 . . . . 0.0 110.619 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 10.5 mmm180 . . . . . 0 C--O 1.233 0.217 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.208 173.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.69 0.281 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -59.34 -54.8 42.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.437 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 60.9 m -58.17 -31.53 67.35 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.408 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.5 tt -64.05 -49.69 71.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.683 176.306 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.496 ' O ' HG23 ' B' ' 471' ' ' VAL . 70.3 t80 -57.05 -56.39 22.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.332 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -62.87 -33.24 74.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -173.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.6 -44.19 82.79 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.068 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.92 -43.44 98.85 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.759 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 467' ' ' PHE . 86.0 t -58.6 -47.67 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 121.038 0.447 . . . . 0.0 110.817 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -39.51 81.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.423 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -76.92 -41.59 42.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.232 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -70.31 -46.02 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.976 -174.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.23 -29.62 67.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.71 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 70.72 -60.43 0.5 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.006 0.816 . . . . 0.0 111.833 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 17.1 t -67.04 127.94 34.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.996 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.03 -23.05 64.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.709 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -75.08 -40.66 59.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.698 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -67.17 -42.26 84.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.228 176.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.513 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 65.4 t80 -65.81 -32.02 73.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.866 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 34.9 tt0 -64.47 -44.58 90.61 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 175.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -44.81 78.21 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 81.9 t80 -55.43 -44.29 76.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.294 0.569 . . . . 0.0 109.978 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.584 ' HB3' HG21 ' A' ' 191' ' ' VAL . 89.3 mt -69.27 -31.19 69.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.354 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.641 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.1 OUTLIER -60.89 -44.06 97.61 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.041 0.448 . . . . 0.0 109.995 173.083 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.0 m -61.23 -36.79 80.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.199 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 45.6 mt -67.48 -47.6 69.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.463 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 14.3 m -65.19 -41.24 91.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.845 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 486' ' ' ARG . 16.1 pt -70.27 -32.94 52.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.944 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -63.68 -44.08 94.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -66.12 -34.01 77.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.533 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -87.79 21.98 2.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.856 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 63.3 25.24 14.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.025 0.441 . . . . 0.0 111.86 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.674 HG13 ' HA ' ' A' ' 161' ' ' TYR . 75.5 t -88.71 -48.47 14.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.34 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 44.1 pt -116.69 160.02 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.463 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.451 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 33.2 m -96.79 -174.0 2.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.18 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.489 ' O ' HG23 ' B' ' 502' ' ' VAL . 20.5 mtp-105 -64.37 -53.35 50.07 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -176.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.21 -48.8 77.89 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -171.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.565 ' HA ' ' HG2' ' B' ' 503' ' ' GLN . 2.5 pm0 -66.29 -32.8 74.42 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.828 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.587 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -58.81 -44.72 90.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.824 0.345 . . . . 0.0 110.487 176.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.507 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.3 OUTLIER -69.82 -41.49 79.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.671 -178.528 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.565 ' HG2' ' HA ' ' B' ' 500' ' ' GLU . 18.8 pt20 -73.71 -23.33 59.77 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -173.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 153' ' ' LEU . 85.4 mt -66.8 -38.31 86.24 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.954 -0.466 . . . . 0.0 110.905 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.622 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.9 p -89.55 6.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.304 0.573 . . . . 0.0 110.599 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.495 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.5 t -61.14 -46.32 95.99 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.851 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.571 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 48.8 Cg_exo -58.63 -16.37 30.06 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.172 1.915 . . . . 0.0 112.765 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -99.95 -52.76 3.34 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.888 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.736 HD22 HD23 ' B' ' 515' ' ' LEU . 76.8 mt -92.09 0.86 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.634 -175.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.6 -17.17 68.61 Favored Glycine 0 C--O 1.23 -0.156 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.513 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.571 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 3.2 mptp? -90.94 -3.54 57.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.388 0.614 . . . . 0.0 109.46 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 43.4 m-85 -129.0 84.79 61.99 Favored Pre-proline 0 N--CA 1.448 -0.567 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.968 -174.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.95 -49.78 16.4 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.42 2.747 . . . . 0.0 112.893 -173.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.98 -34.03 75.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.385 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.736 HD23 HD22 ' B' ' 509' ' ' LEU . 9.8 tp -78.12 -43.78 27.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.377 -173.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.61 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 52.4 t80 -68.13 -37.31 80.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.091 178.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.42 -34.04 75.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.21 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -59.41 -48.47 81.5 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 175.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.529 ' O ' HD13 ' B' ' 523' ' ' LEU . 3.2 t80 -58.04 -44.03 87.15 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.185 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.61 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 88.7 mttt -60.16 -44.07 95.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.073 175.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -63.87 -39.51 94.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.508 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -70.55 -31.58 68.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.44 0.638 . . . . 0.0 110.045 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.587 HD21 HD23 ' B' ' 501' ' ' LEU . 10.6 mp -88.1 1.19 54.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.924 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 59.25 37.31 91.65 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.025 -178.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 525' ' ' TYR . . . . . 0.4 ' HD2' ' HG2' ' B' ' 520' ' ' LYS . 19.2 t80 . . . . . 0 C--N 1.322 -0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 110.944 -175.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.7 m . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.809 0.338 . . . . 0.0 110.473 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.52 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 15.2 Cg_exo -68.59 142.98 55.14 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.823 2.349 . . . . 0.0 111.612 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -100.73 141.32 33.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.6 p -84.44 129.39 37.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 110.561 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.31 100.63 9.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.06 3.29 53.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.2 0.524 . . . . 0.0 110.668 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -76.6 -27.63 55.84 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.619 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.2 OUTLIER -51.82 -41.5 61.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.824 171.51 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.582 HD21 HD11 ' B' ' 504' ' ' LEU . 64.5 mt -61.01 128.19 35.23 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.837 -178.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -62.36 160.86 12.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.521 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.7 -44.18 69.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.122 0.486 . . . . 0.0 110.362 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.59 -37.97 88.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.057 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.408 HG21 HD22 ' A' ' 153' ' ' LEU . 10.6 m -64.35 -45.2 88.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.987 0.422 . . . . 0.0 110.556 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 71.8 mt -59.86 -46.84 88.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.584 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -63.84 -34.94 79.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.84 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' B' ' 494' ' ' GLU . 13.7 ttm180 -66.1 -46.47 77.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.561 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.44 ' HA ' HG13 ' B' ' 495' ' ' VAL . 83.7 t80 -52.52 -48.02 66.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.365 173.534 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.588 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 6.5 mtpm? -65.46 -34.78 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.427 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -75.27 -40.54 58.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.762 0.315 . . . . 0.0 111.032 -176.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -74.48 -43.71 54.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.804 0.335 . . . . 0.0 111.327 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.439 ' CE1' HG22 ' B' ' 490' ' ' ILE . 39.2 m-85 -85.48 0.24 52.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.353 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 57.39 73.12 0.48 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.433 176.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.588 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 76.0 mt -113.69 135.23 21.95 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.856 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.16 157.4 25.63 Favored 'Trans proline' 0 C--O 1.238 0.476 0 C-N-CA 123.243 2.629 . . . . 0.0 112.381 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.544 ' HB ' HD11 ' A' ' 173' ' ' LEU . 13.8 p . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.43 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.544 HD11 ' HB ' ' A' ' 169' ' ' THR . 83.3 mt . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 121.297 0.57 . . . . 0.0 111.748 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.761 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 14.0 m120 -138.54 179.75 6.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.033 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 179' ' ' VAL . 27.7 tptp -57.4 -53.45 58.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.881 0.372 . . . . 0.0 110.798 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.89 -27.84 67.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.295 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.761 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 31.5 mm-40 -67.77 -44.76 76.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.42 0.629 . . . . 0.0 110.154 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 91.2 mt -64.13 -42.71 96.72 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.837 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 175' ' ' LYS . 67.9 t -60.66 -42.41 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.544 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 177' ' ' GLN . 8.0 pt-20 -67.94 -40.85 83.23 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.259 -177.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 180' ' ' GLU . 60.0 mt -67.46 -48.71 76.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 120.916 0.389 . . . . 0.0 110.257 176.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 55.0 t -58.21 -49.05 83.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.706 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.39 96.28 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.546 -177.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 46.7 t -59.05 -46.41 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.969 0.414 . . . . 0.0 110.619 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.77 -26.28 31.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.231 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.494 ' HE1' HD13 ' B' ' 490' ' ' ILE . 35.6 t80 -66.33 -34.85 78.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.176 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -78.33 10.23 3.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.611 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.9 p -136.09 38.82 2.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.948 0.404 . . . . 0.0 111.332 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.89 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 73.8 mt -102.39 115.75 63.98 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.436 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.86 113.22 2.92 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 122.669 2.246 . . . . 0.0 111.918 177.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.603 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.1 p -115.75 154.21 17.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.761 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -118.62 112.89 20.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.561 ' HA ' HD22 ' B' ' 485' ' ' LEU . 32.6 tt0 -51.3 -65.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -58.4 -48.9 79.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.571 0.224 . . . . 0.0 111.356 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.46 -45.76 78.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.837 -174.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 196' ' ' THR . . . . . 0.52 ' HB ' HD23 ' B' ' 485' ' ' LEU . 85.3 m -68.7 -37.37 79.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.848 -0.16 . . . . 0.0 110.903 -176.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 53.3 mt -60.73 -47.34 86.75 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 40.7 m -57.91 -47.2 83.52 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.644 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.4 -48.24 82.4 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.57 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.54 ' CG ' HD22 ' B' ' 488' ' ' LEU . 68.8 t80 -64.63 -47.95 76.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.285 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' B' ' 468' ' ' PHE . 78.8 mt -57.44 -44.62 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.021 -177.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -71.07 -35.0 71.73 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.185 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 73.8 m -60.89 -50.23 74.27 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.733 0.301 . . . . 0.0 110.866 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 200' ' ' PHE . 20.4 t -71.48 -33.51 49.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.064 -177.025 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.456 178.256 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 463' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.9 p . . . . . 0 N--CA 1.452 -0.366 0 CA-C-O 120.695 0.283 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 50.9 mp0 -62.93 -51.21 67.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.909 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 17.0 t -63.93 -33.32 75.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.95 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 42.7 tp -58.17 -53.9 53.07 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.169 175.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.451 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.3 t80 -54.03 -55.07 30.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.925 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.473 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.6 m-85 -61.36 -39.5 90.85 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -174.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.8 -39.93 95.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.82 0.343 . . . . 0.0 110.337 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 470' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.3 mttt -63.01 -46.25 88.53 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.184 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 467' ' ' PHE . 85.5 t -57.09 -44.47 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.139 0.495 . . . . 0.0 110.521 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -58.43 -42.33 87.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.967 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -80.28 -44.86 18.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.035 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.511 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -61.88 -42.45 99.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 475' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' B' ' 477' ' ' SER . 10.6 mp -71.57 -37.95 71.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.217 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 ttp85 70.48 -36.78 0.37 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.976 0.91 . . . . 0.0 111.935 177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 477' ' ' SER . . . . . 0.421 ' H ' ' C ' ' B' ' 475' ' ' LEU . 30.1 t -80.51 121.6 25.98 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.901 0.382 . . . . 0.0 110.875 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.95 72.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.706 177.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -63.34 -42.0 98.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.147 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.06 -40.98 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.243 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.548 ' O ' HD12 ' B' ' 485' ' ' LEU . 72.9 t80 -62.51 -45.01 94.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.395 0.617 . . . . 0.0 109.481 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 38.9 tt0 -57.29 -43.94 83.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.038 176.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -56.71 -43.92 81.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.801 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -54.77 -51.44 65.73 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.603 ' HB3' HG21 ' A' ' 191' ' ' VAL . 1.5 mp -66.01 -26.25 67.45 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.89 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.0 mtt85 -68.0 -37.35 81.36 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.801 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 47.6 m -63.08 -32.01 73.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.222 0.534 . . . . 0.0 109.741 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.54 HD22 ' CG ' ' A' ' 200' ' ' PHE . 72.0 mt -68.18 -45.71 72.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.356 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 19.4 m -66.01 -40.89 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.555 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.494 HD13 ' HE1' ' A' ' 186' ' ' PHE . 17.3 pt -69.66 -30.82 46.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -66.32 -42.15 88.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 110.006 174.481 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.6 -35.58 81.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.561 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -89.62 26.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.019 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 494' ' ' GLU . . . . . 0.549 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 12.4 pt-20 46.14 32.41 1.43 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.29 1.036 . . . . 0.0 112.649 177.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.478 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 63.8 t -81.76 -42.55 19.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.4 pt -116.13 175.87 2.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 16.3 m -115.15 174.95 5.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.065 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.46 ' O ' HG23 ' B' ' 502' ' ' VAL . 60.8 ttp180 -57.51 -52.39 65.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.506 0.193 . . . . 0.0 110.675 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.5 -46.61 83.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.834 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.8 mm-40 -56.02 -50.44 70.91 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.464 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.518 HD23 HD21 ' B' ' 523' ' ' LEU . 64.3 tp -59.79 -49.0 79.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.405 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.536 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 93.1 t -59.89 -38.52 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.619 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 16.2 mm100 -72.25 -38.91 68.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.413 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.582 HD11 HD21 ' A' ' 153' ' ' LEU . 65.6 mt -58.64 -37.55 76.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.475 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.1 p -91.22 6.01 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.056 0.455 . . . . 0.0 111.4 -175.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.606 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 93.4 p -63.07 -42.17 75.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.606 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 25.8 Cg_exo -65.96 -10.49 27.15 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.88 1.72 . . . . 0.0 112.367 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -99.16 -57.2 2.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.475 ' HG ' HG22 ' B' ' 505' ' ' VAL . 57.3 mt -92.49 3.04 56.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.811 -175.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.59 -22.58 71.67 Favored Glycine 0 N--CA 1.454 -0.12 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.966 -177.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.437 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.7 mptp? -87.37 -2.42 58.6 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.511 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 46.3 m-85 -127.04 90.81 48.44 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.923 -176.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.45 -47.21 20.2 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.35 2.7 . . . . 0.0 113.282 -172.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 514' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' B' ' 514' ' ' GLU . 0.0 OUTLIER -72.51 -32.72 66.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.898 0.38 . . . . 0.0 110.918 -176.531 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.473 HD23 HD22 ' B' ' 509' ' ' LEU . 15.8 tp -71.31 -43.74 66.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.072 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.525 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 28.5 t80 -66.61 -34.97 79.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.995 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -63.87 -39.85 95.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.648 175.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -58.1 -49.06 78.25 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.536 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 37.3 t80 -56.67 -45.86 81.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.763 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.525 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.0 mttt -58.87 -39.98 83.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.721 0.296 . . . . 0.0 111.471 178.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -71.22 -38.72 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.304 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -64.61 -45.34 87.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.849 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.518 HD21 HD23 ' B' ' 501' ' ' LEU . 5.6 mp -83.28 -2.72 56.34 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 64.51 52.32 44.28 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.772 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 . . . . . 0 C--N 1.329 -0.319 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.807 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 90.3 m . . . . . 0 C--O 1.233 0.2 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 9.4 Cg_exo -71.35 158.72 53.65 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.252 1.968 . . . . 0.0 110.791 173.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -108.82 145.27 35.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.029 0.443 . . . . 0.0 111.339 -175.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.74 135.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.774 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -105.62 131.99 52.31 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.619 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.424 HD13 HG12 ' A' ' 182' ' ' VAL . 96.2 mt -110.28 5.9 22.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.145 0.497 . . . . 0.0 110.471 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -84.99 -24.19 28.36 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 -28.3 69.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.437 172.734 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.503 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -63.75 158.16 22.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.104 0.478 . . . . 0.0 110.989 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -78.78 148.95 32.76 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.454 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.528 HG13 ' CD1' ' A' ' 178' ' ' LEU . 85.6 t -53.96 -45.29 63.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 CA-C-O 121.198 0.523 . . . . 0.0 110.317 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -60.3 -36.6 78.26 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.631 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 26.7 m -68.23 -43.75 77.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.098 0.475 . . . . 0.0 110.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.401 HD22 HG21 ' A' ' 182' ' ' VAL . 88.0 mt -65.03 -38.54 91.22 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.352 0.596 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 79.9 mtp180 -70.72 -30.59 67.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.309 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.496 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 42.2 ttm105 -70.46 -42.76 71.05 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.651 ' HA ' HG13 ' B' ' 495' ' ' VAL . 52.2 t80 -48.86 -58.2 5.2 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.071 173.514 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 6.4 ptpp? -67.97 -27.37 66.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.71 -176.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 163' ' ' ARG . 38.7 ttm180 -67.81 -51.62 46.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 177.308 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -67.31 -37.2 82.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.011 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -88.85 0.15 56.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt 59.69 74.94 0.42 Allowed 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.669 0.606 . . . . 0.0 111.984 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.614 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 82.5 mt -117.6 110.63 40.38 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.96 176.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.08 127.38 16.7 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.672 2.248 . . . . 0.0 112.129 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.547 HG22 HD13 ' A' ' 181' ' ' ILE . 30.7 p . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 120.987 0.422 . . . . 0.0 111.9 -175.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.545 HD11 ' HB ' ' A' ' 169' ' ' THR . 97.9 mt . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.93 0.395 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.446 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 16.2 t-20 -120.37 167.24 12.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.502 ' HD3' HG22 ' A' ' 155' ' ' VAL . 21.7 tptm -54.38 -52.49 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.555 0.342 . . . . 0.0 111.29 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 176' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.48 -36.81 76.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.349 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -64.42 -44.01 92.54 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.15 0.5 . . . . 0.0 110.167 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.528 ' CD1' HG13 ' A' ' 155' ' ' VAL . 85.7 mt -62.38 -41.17 98.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.778 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 71.2 t -62.28 -43.98 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 123.622 0.576 . . . . 0.0 111.114 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 48.4 mt-10 -61.05 -44.74 96.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.789 0.328 . . . . 0.0 110.771 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.547 HD13 HG22 ' A' ' 169' ' ' THR . 72.5 mt -63.58 -50.62 77.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.581 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.424 HG12 HD13 ' A' ' 150' ' ' LEU . 69.1 t -61.03 -46.18 97.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.557 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.21 -40.61 99.28 Favored Glycine 0 N--CA 1.448 -0.546 0 O-C-N 123.368 0.417 . . . . 0.0 112.618 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -60.02 -43.31 95.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.358 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -78.87 -28.83 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.597 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.1 -29.98 70.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.537 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -80.75 0.41 34.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.11 176.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.8 t -126.1 24.81 6.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.892 0.377 . . . . 0.0 110.74 -175.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.848 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.4 mt -90.17 117.47 68.07 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.885 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.67 118.79 5.6 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.542 2.161 . . . . 0.0 111.157 174.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.431 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -133.42 154.93 39.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.486 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -132.11 128.25 37.73 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.519 ' HG3' ' HE2' ' B' ' 481' ' ' TYR . 34.7 tt0 -51.98 -63.83 1.01 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.94 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -57.08 -53.74 54.69 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.038 0.447 . . . . 0.0 112.059 -174.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -65.61 -46.6 78.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.911 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.5 m -67.03 -36.7 82.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.375 -176.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 45.0 mt -60.64 -45.86 92.51 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 61.1 m -56.97 -45.54 82.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.741 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 62.5 m -60.08 -54.52 45.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.085 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.549 ' CD1' HD22 ' B' ' 488' ' ' LEU . 71.9 t80 -57.27 -48.29 79.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.278 -177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.487 ' O ' ' HB2' ' A' ' 205' ' ' ARG . 87.8 mt -61.0 -47.23 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.488 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -65.29 -36.45 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.188 -175.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -69.53 -61.22 1.87 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.853 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.22 -29.12 46.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -170.606 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 201' ' ' ILE . 11.7 mtp180 . . . . . 0 C--N 1.327 -0.386 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 10.0 p . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.632 0.253 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.477 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 0.8 OUTLIER -63.14 -47.46 82.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.096 176.341 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.6 m -60.24 -39.55 87.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.259 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 44.9 tp -59.08 -51.74 68.76 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.481 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.6 t80 -53.89 -56.96 12.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.739 178.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -64.37 -36.58 84.61 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -173.112 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.45 -41.92 88.38 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.586 -0.446 . . . . 0.0 109.965 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 470' ' ' LYS . . . . . 0.401 ' HD2' HD13 ' B' ' 515' ' ' LEU . 38.9 ttmt -62.38 -43.95 97.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.067 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.648 HG13 HD21 ' B' ' 509' ' ' LEU . 86.7 t -59.96 -51.91 67.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.16 0.505 . . . . 0.0 110.782 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -58.7 -34.1 70.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.202 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 473' ' ' LYS . . . . . 0.448 ' HB2' ' HE3' ' B' ' 473' ' ' LYS . 36.9 ttmt -85.19 -31.93 22.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.511 -176.053 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.89 -39.6 30.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.644 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 475' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' B' ' 477' ' ' SER . 66.0 mt -62.91 -35.65 80.77 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.934 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 476' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 476' ' ' ARG . 35.4 ttt180 71.81 -28.58 0.19 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.818 0.699 . . . . 0.0 111.836 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 477' ' ' SER . . . . . 0.455 ' H ' ' C ' ' B' ' 475' ' ' LEU . 1.2 p -96.09 120.39 36.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.058 -177.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.72 99.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -60.51 -35.16 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.084 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.51 -36.8 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 0.0 110.734 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.519 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 44.0 t80 -71.69 -34.57 69.76 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 42.6 tt0 -62.62 -43.03 99.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.709 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.67 -48.58 69.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.705 174.313 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.447 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 83.9 t80 -55.11 -48.73 73.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.525 176.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 95.3 mt -64.53 -32.21 73.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.644 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.848 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.6 mtt180 -68.89 -38.22 79.51 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.483 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.3 -35.49 75.71 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.013 0.435 . . . . 0.0 109.931 172.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.549 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -65.57 -52.19 54.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.067 179.067 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.529 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -61.81 -39.63 84.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.1 pt -69.83 -31.04 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.652 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -67.29 -38.22 84.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 109.97 171.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -72.79 -5.2 36.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.459 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -115.14 13.39 16.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.154 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 59.29 29.33 18.87 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.472 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.651 HG13 ' HA ' ' A' ' 161' ' ' TYR . 71.4 t -80.59 -51.03 16.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.1 0.476 . . . . 0.0 110.333 178.162 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.5 pt -108.51 167.15 4.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.15 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 27.0 t -101.34 177.75 4.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.949 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.568 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 52.5 ttp180 -59.01 -59.46 5.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.179 0.514 . . . . 0.0 110.685 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 499' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -57.35 -40.98 79.21 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.565 -179.236 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.45 -42.81 74.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.103 0.477 . . . . 0.0 110.213 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 10.5 tt -64.84 -45.8 84.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.33 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.533 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.1 OUTLIER -64.19 -32.51 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.516 -179.239 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -43.13 79.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.145 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.503 HD21 HD21 ' A' ' 153' ' ' LEU . 49.3 mt -58.72 -43.51 90.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.106 -177.536 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.537 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -91.58 7.91 4.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.15 0.5 . . . . 0.0 111.038 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.578 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 20.6 t -59.5 -49.49 92.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.927 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 47.3 Cg_exo -59.68 -17.17 40.94 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.256 1.971 . . . . 0.0 112.898 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -95.9 -57.32 2.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.351 -175.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.663 HD22 HD23 ' B' ' 515' ' ' LEU . 53.2 mt -99.26 -9.4 23.68 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -173.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.16 -23.07 71.27 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.527 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.78 -5.1 52.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.667 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.403 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 65.9 m-85 -122.12 92.46 48.87 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.783 177.269 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 513' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 7.7 Cg_endo -49.64 -48.0 20.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.606 2.871 . . . . 0.0 113.268 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.84 -34.41 77.87 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.088 0.471 . . . . 0.0 111.095 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.663 HD23 HD22 ' B' ' 509' ' ' LEU . 12.9 tp -78.44 -43.8 26.31 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.016 -174.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.533 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 11.8 t80 -69.75 -32.27 70.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.853 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 517' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' B' ' 520' ' ' LYS . 25.5 t-20 -66.33 -37.68 85.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.309 175.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.477 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 27.2 t90 -58.02 -46.98 84.41 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.3 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -38.5 87.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.93 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 516' ' ' PHE . 34.0 mmtp -53.27 -50.52 64.67 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.335 0.588 . . . . 0.0 110.168 174.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.54 -36.27 78.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.86 -175.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -72.78 -39.32 66.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.543 -174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.568 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 10.6 mp -81.53 -19.58 41.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.934 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 74.08 28.22 64.83 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.829 -0.908 . . . . 0.0 110.829 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 36.9 t80 . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 121.171 0.51 . . . . 0.0 110.284 -175.628 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.2 m . . . . . 0 C--O 1.233 0.193 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.472 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 11.4 Cg_exo -69.68 155.18 66.88 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.711 2.274 . . . . 0.0 111.686 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -107.59 163.91 12.67 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.718 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.8 p -119.85 121.37 65.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.205 0.526 . . . . 0.0 110.819 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -74.2 118.61 17.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.073 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 62.5 mt -106.72 -6.9 17.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.96 0.41 . . . . 0.0 110.841 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.491 ' HA ' HG21 ' A' ' 179' ' ' VAL . 1.9 t80 -75.21 -14.29 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.393 0.615 . . . . 0.0 109.345 176.39 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.27 -24.64 59.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.9 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.696 HD21 HD21 ' B' ' 504' ' ' LEU . 29.7 mt -68.58 160.25 30.38 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.26 0.552 . . . . 0.0 111.42 -173.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -78.12 156.24 30.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.094 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.46 HG13 ' CD1' ' A' ' 178' ' ' LEU . 50.2 t -58.92 -44.27 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -56.97 -44.54 82.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.671 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.722 HG21 ' HG2' ' B' ' 500' ' ' GLU . 35.8 m -62.93 -48.38 79.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.112 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 95.5 mt -63.28 -44.61 94.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 50.5 mtp180 -65.18 -35.88 82.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.615 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -68.14 -43.82 77.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.612 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -53.26 -50.0 65.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.074 0.464 . . . . 0.0 110.302 174.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.566 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 59.7 mtpt -67.83 -29.02 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.615 -177.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.416 ' O ' ' HD3' ' A' ' 166' ' ' LYS . 44.6 ttm180 -79.72 -43.64 22.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.629 0.252 . . . . 0.0 111.024 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -69.15 -42.66 75.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.737 0.304 . . . . 0.0 110.631 -177.564 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -84.28 -1.31 55.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.53 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 163' ' ' ARG . 71.7 mmtt 58.35 66.74 1.04 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.464 178.29 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.523 HD13 HG22 ' A' ' 181' ' ' ILE . 94.6 mt -101.18 137.31 19.66 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.499 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.34 139.63 78.23 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.825 2.35 . . . . 0.0 111.953 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 37.6 p . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.803 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 121.362 0.601 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.631 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 17.8 m120 -137.14 176.35 8.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.015 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -55.84 -48.73 74.97 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.386 0.429 . . . . 0.0 110.698 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.11 93.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.248 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.631 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 27.9 mm-40 -60.76 -40.42 92.43 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.454 0.645 . . . . 0.0 110.644 -178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 81.7 mt -63.61 -51.88 63.33 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.745 177.432 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.491 HG21 ' HA ' ' A' ' 151' ' ' TYR . 96.7 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 123.622 0.576 . . . . 0.0 111.695 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.52 -49.18 77.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.465 -178.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.566 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 65.8 mt -70.6 -42.88 78.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 -179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 178' ' ' LEU . 56.0 t -59.26 -49.38 83.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.389 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.426 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.68 -37.54 94.51 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.424 -0.417 . . . . 0.0 112.661 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.9 t -57.9 -43.05 85.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.912 0.387 . . . . 0.0 110.586 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -86.65 -27.59 23.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.832 0.348 . . . . 0.0 111.17 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.471 ' HE1' HD13 ' B' ' 490' ' ' ILE . 50.3 t80 -61.77 -42.73 99.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 -176.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -78.19 17.94 0.57 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 34.9 p -140.59 19.72 2.36 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.457 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.985 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 81.6 mt -78.7 124.03 85.25 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.96 140.55 42.18 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.252 1.968 . . . . 0.0 110.907 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.95 155.78 6.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.919 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -125.32 115.17 19.92 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.3 tt0 -47.78 -64.76 0.7 Allowed 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -172.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -64.7 -45.84 84.91 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -173.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.24 -41.54 89.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.769 0.319 . . . . 0.0 110.92 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.5 m -66.13 -40.16 90.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.917 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 50.0 mt -58.82 -46.68 87.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 55.8 m -56.04 -48.81 75.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.741 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 60.3 m -57.21 -55.23 37.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.236 177.289 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.637 ' CD1' HD22 ' B' ' 488' ' ' LEU . 41.6 t80 -52.03 -52.94 47.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.562 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.541 HD11 ' HE2' ' B' ' 468' ' ' PHE . 84.4 mt -56.71 -55.35 20.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.248 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.21 -29.74 63.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -173.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -63.81 -55.27 24.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.343 176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD23 ' B' ' 523' ' ' LEU . 58.2 t -65.18 -32.21 57.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.637 -175.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.452 ' HD3' HG22 ' A' ' 201' ' ' ILE . 23.8 mtp180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 112.168 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.0 p . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 120.901 0.382 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.475 ' HA ' ' CH2' ' B' ' 518' ' ' TRP . 3.4 mp0 -58.78 -43.53 90.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.752 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 15.9 m -63.57 -33.01 74.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.003 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 54.8 tp -65.59 -43.25 90.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.21 0.528 . . . . 0.0 109.862 177.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.452 ' O ' HG23 ' B' ' 471' ' ' VAL . 64.6 t80 -54.96 -49.19 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.994 173.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.1 m-85 -66.18 -32.07 73.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.77 -177.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.91 -46.31 91.17 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -60.91 -49.08 78.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.834 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 467' ' ' PHE . 92.5 t -59.49 -51.71 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.841 0.353 . . . . 0.0 111.345 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -58.97 -41.68 88.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.519 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 473' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' B' ' 473' ' ' LYS . 21.9 ttmt -75.77 -34.35 60.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.317 -175.757 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.82 -41.27 26.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.716 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.56 -41.96 87.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 121.101 -0.239 . . . . 0.0 110.831 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 476' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' B' ' 476' ' ' ARG . 40.2 ttt180 70.6 -56.12 0.61 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.847 0.717 . . . . 0.0 111.688 176.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 28.4 t -65.89 129.62 40.4 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.082 -179.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.02 -40.95 87.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.946 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.88 -31.11 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 0.0 110.054 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.472 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.64 -43.51 65.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 177.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.491 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 76.8 t80 -65.54 -39.67 91.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 176.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.5 tt0 -60.09 -43.56 95.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.847 174.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.11 -44.7 75.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.821 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.472 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 51.2 t80 -57.53 -48.52 79.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.312 175.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 193' ' ' GLU . 87.2 mt -63.91 -33.1 74.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.171 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.985 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 20.0 mtt85 -66.12 -38.17 87.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.928 0.394 . . . . 0.0 110.452 177.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 53.7 m -62.03 -34.34 76.05 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 173.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.637 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -68.11 -46.85 69.78 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.412 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.498 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.6 m -64.85 -42.57 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.634 -178.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.471 HD13 ' HE1' ' A' ' 186' ' ' PHE . 22.9 pt -69.51 -29.59 42.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.848 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.33 -42.47 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.105 0.479 . . . . 0.0 109.889 172.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -67.26 -32.57 73.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.965 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.53 7.8 16.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 65.62 21.8 11.68 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.371 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.459 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 95.2 t -75.5 -43.07 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.973 0.416 . . . . 0.0 110.096 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.53 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 36.2 pt -120.17 154.96 23.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.717 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 28.3 p -98.99 -171.3 2.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.292 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.567 ' O ' HG23 ' B' ' 502' ' ' VAL . 45.2 ttp180 -55.77 -42.12 75.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.419 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -60.23 -53.4 58.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.571 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.722 ' HG2' HG21 ' A' ' 157' ' ' THR . 2.3 mp0 -60.63 -41.72 95.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.78 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.51 -41.99 86.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.763 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.567 HG23 ' O ' ' B' ' 498' ' ' ARG . 67.3 t -69.4 -40.71 80.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.894 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -74.68 -41.65 59.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.176 -175.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.696 HD21 HD21 ' A' ' 153' ' ' LEU . 91.0 mt -61.26 -36.92 81.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 111.636 -175.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -92.16 6.81 5.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.969 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.526 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 34.9 t -59.77 -48.33 95.37 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.737 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.526 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 24.0 Cg_exo -66.3 -1.56 5.69 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.946 1.764 . . . . 0.0 112.731 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.65 -61.68 1.61 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.764 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' B' ' 505' ' ' VAL . 48.1 mt -89.35 -21.16 23.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.151 -175.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -70.44 -10.18 66.02 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.452 -177.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -79.9 -11.83 59.78 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.463 ' HB2' ' HB3' ' B' ' 515' ' ' LEU . 60.5 m-85 -124.95 104.33 30.0 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.054 -178.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.13 -50.45 13.36 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.523 2.815 . . . . 0.0 113.586 -175.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -66.51 -41.47 88.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.095 0.474 . . . . 0.0 110.665 -177.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 22.2 tp -67.0 -45.71 76.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.727 -175.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -67.28 -32.34 73.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.351 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.15 -47.49 79.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.463 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.475 ' CH2' ' HA ' ' B' ' 464' ' ' GLU . 4.9 t90 -57.16 -48.56 78.4 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.753 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.516 ' CZ ' HD11 ' B' ' 523' ' ' LEU . 39.5 t80 -56.82 -50.69 71.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.495 -178.105 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.2 -38.29 90.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.2 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -44.42 91.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.586 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -63.03 -41.38 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.633 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.573 HD23 HG11 ' A' ' 204' ' ' VAL . 88.7 mt -71.08 -26.64 63.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.489 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.55 33.87 15.32 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -173.374 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.444 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 53.7 Cg_exo -54.09 147.94 41.77 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.699 2.266 . . . . 0.0 112.131 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -126.64 149.72 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.122 0.487 . . . . 0.0 111.111 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.626 HG21 HD21 ' B' ' 483' ' ' ASN . 0.8 OUTLIER -95.47 138.73 20.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.915 -175.544 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.46 -46.87 68.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.831 0.824 . . . . 0.0 109.787 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.583 HD23 HD22 ' B' ' 504' ' ' LEU . 40.2 mt 60.28 10.04 2.2 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.527 -1.67 . . . . 0.0 111.553 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -94.03 -10.96 31.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -70.39 -29.95 66.72 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.584 HD21 HD21 ' B' ' 504' ' ' LEU . 19.2 mt -59.31 131.62 51.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.219 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -72.29 163.61 27.67 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.914 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.54 -44.17 80.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.758 0.313 . . . . 0.0 110.744 -178.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 24.8 p30 -61.77 -35.43 78.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 48.1 m -71.78 -46.84 57.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.693 0.282 . . . . 0.0 110.97 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.654 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 88.1 mt -60.84 -46.82 89.05 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.226 0.536 . . . . 0.0 110.46 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.462 ' HA ' ' HD3' ' A' ' 162' ' ' LYS . 29.5 mtp180 -65.12 -31.83 73.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.677 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 156' ' ' ASN . 39.3 ttm180 -67.24 -46.81 72.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.266 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -52.94 -49.76 65.36 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.025 0.44 . . . . 0.0 110.335 174.594 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 159' ' ' ARG . 7.9 mtpm? -57.7 -45.35 85.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.881 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -81.91 -31.7 31.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.514 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -72.57 -37.99 68.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.556 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -88.41 -8.07 55.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.239 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm 61.33 69.99 0.63 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.766 0.666 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 84.9 mt -105.93 145.15 30.34 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.233 -178.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 21.5 Cg_exo -65.68 150.73 86.03 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.182 2.588 . . . . 0.0 111.928 176.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.092 0.473 . . . . 0.0 112.115 -175.198 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 85.6 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 121.136 0.493 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.732 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 26.9 m-80 -141.66 177.34 8.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.589 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -56.78 -52.11 66.32 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.182 0.301 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.9 -30.03 69.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.736 0.303 . . . . 0.0 110.847 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.732 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 25.4 mm-40 -64.58 -42.54 95.56 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.146 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 75.3 mt -62.72 -46.97 85.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.056 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.79 -46.03 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.281 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -60.1 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.45 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.2 -49.54 80.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.6 t -59.13 -49.47 83.24 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.91 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.31 92.12 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 121.49 -0.386 . . . . 0.0 112.835 -176.455 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.48 -48.97 79.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -80.77 -26.14 37.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.034 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.503 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.9 t80 -57.28 -48.59 78.52 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 -179.149 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.9 45.95 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 0.0 111.417 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 61.7 m -152.02 11.38 0.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.196 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.792 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 79.1 mt -89.34 120.93 69.75 Favored Pre-proline 0 C--O 1.234 0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.619 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 190' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 8.1 Cg_exo -72.08 148.07 49.86 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.836 2.357 . . . . 0.0 111.732 177.698 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.26 129.8 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 0.0 111.327 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 192' ' ' ASN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 195' ' ' ASP . 26.5 t-20 -91.44 119.63 31.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 169.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 42.4 tt0 -51.63 -54.17 30.72 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.388 0.43 . . . . 0.0 111.474 -173.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -59.24 -51.47 69.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 195' ' ' ASP . . . . . 0.4 ' HB3' ' HB3' ' A' ' 192' ' ' ASN . 38.4 t70 -62.85 -43.94 97.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.328 -176.237 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 196' ' ' THR . . . . . 0.437 HG21 ' HB3' ' B' ' 485' ' ' LEU . 19.9 m -66.34 -42.69 87.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.299 -176.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 80.3 mt -62.98 -41.82 99.66 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 28.3 m -57.46 -46.23 83.87 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.375 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 95.0 m -56.87 -56.19 24.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.478 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.53 ' CG ' HD22 ' B' ' 488' ' ' LEU . 56.1 t80 -62.72 -55.5 26.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.603 -175.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 67.4 mt -56.43 -55.67 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.231 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.89 -34.82 78.62 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -173.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -64.99 -51.63 60.65 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.724 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD12 ' B' ' 523' ' ' LEU . 44.4 t -68.92 -28.72 40.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 120.986 0.422 . . . . 0.0 111.05 174.551 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.452 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.473 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -63.58 -38.66 91.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.833 0.349 . . . . 0.0 110.627 177.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 9.9 m -59.26 -43.71 92.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.244 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.73 -48.42 81.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.896 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.2 t80 -53.48 -52.9 58.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.06 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.467 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.0 m-85 -70.18 -28.93 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -174.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.21 -40.79 82.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -57.95 -50.27 73.95 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.368 172.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 467' ' ' PHE . 84.1 t -54.51 -42.23 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.869 0.366 . . . . 0.0 110.976 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -54.93 -51.57 65.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.313 177.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -78.46 -33.23 48.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.834 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.722 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -70.37 -45.84 65.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.75 -30.67 68.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.679 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 476' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' B' ' 474' ' ' ALA . 13.3 mtp180 68.94 -51.95 0.58 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.683 0.793 . . . . 0.0 112.427 173.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.4 t -78.77 137.8 37.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.882 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.98 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.594 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.12 -38.77 91.72 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.525 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.16 -47.3 74.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.975 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.467 ' CE2' HD11 ' B' ' 485' ' ' LEU . 91.3 t80 -65.62 -42.92 91.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.543 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.1 tt0 -59.43 -40.81 87.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.676 177.251 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.626 HD21 HG21 ' A' ' 148' ' ' VAL . 3.0 t30 -57.93 -47.61 82.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.686 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -51.73 -49.91 61.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.95 174.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.467 HD11 ' CE2' ' B' ' 481' ' ' TYR . 71.7 mt -63.05 -34.37 77.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.22 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.792 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.2 mtt85 -66.52 -36.54 82.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 51.4 m -61.44 -36.42 80.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.23 0.538 . . . . 0.0 109.657 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 61.9 mt -66.11 -47.74 73.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.569 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.576 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.5 m -65.77 -42.16 91.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -176.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.474 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 22.7 pt -68.48 -31.39 51.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.601 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.18 -42.02 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.291 0.567 . . . . 0.0 110.02 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -65.95 -31.36 72.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.759 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 493' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 77.1 mt-30 -90.39 15.03 11.36 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.552 -177.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 68.75 10.93 8.17 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.128 0.571 . . . . 0.0 112.226 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.474 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 90.0 t -68.85 -55.51 15.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.089 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.419 HG12 HG13 ' B' ' 490' ' ' ILE . 42.3 pt -111.83 152.45 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.436 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 58.2 m -102.5 -177.28 3.35 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.784 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.574 ' O ' HG23 ' B' ' 502' ' ' VAL . 40.2 ttp180 -57.25 -45.94 83.5 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.643 -175.406 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.89 -51.03 71.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.776 0.322 . . . . 0.0 111.036 -178.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.7 mp0 -60.21 -44.33 95.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 179.442 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.47 -46.85 80.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.067 0.461 . . . . 0.0 110.955 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 498' ' ' ARG . 88.5 t -63.1 -35.91 73.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.883 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -77.56 -30.02 52.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.584 HD21 HD21 ' A' ' 153' ' ' LEU . 86.2 mt -71.21 -39.72 71.58 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.29 7.1 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.255 0.55 . . . . 0.0 110.864 -177.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.641 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 31.7 t -57.95 -52.75 72.16 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.721 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.0 Cg_exo -66.67 -3.39 9.16 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.286 1.991 . . . . 0.0 112.931 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.583 ' CZ ' HG22 ' A' ' 148' ' ' VAL . 95.8 m-85 -109.27 -53.78 2.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.425 -175.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.586 HD22 HD23 ' B' ' 515' ' ' LEU . 87.1 mt -107.1 -6.42 17.41 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -176.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.03 -15.61 69.71 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.006 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' B' ' 512' ' ' PHE . 0.0 OUTLIER -84.75 1.97 44.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.523 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.722 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 87.9 m-85 -128.54 93.33 38.29 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.853 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 513' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.0 Cg_endo -52.55 -54.08 5.78 Favored 'Trans proline' 0 CA--C 1.528 0.198 0 C-N-CA 123.537 2.825 . . . . 0.0 113.345 -173.74 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -66.94 -33.26 75.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 0.0 111.207 -176.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.586 HD23 HD22 ' B' ' 509' ' ' LEU . 16.3 tp -74.84 -39.16 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 110.26 -178.123 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -70.15 -30.31 67.43 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 176.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.31 -45.19 95.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.851 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.473 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 19.0 t90 -56.23 -48.41 76.54 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.744 176.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -47.04 76.99 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.537 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.2 -39.82 91.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -66.46 -37.36 84.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.047 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -71.86 -35.12 69.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.112 0.482 . . . . 0.0 110.395 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.573 HD12 HG11 ' A' ' 204' ' ' VAL . 5.2 mp -86.92 -7.15 58.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.492 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.72 40.27 97.84 Favored Glycine 0 N--CA 1.452 -0.248 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 -175.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 45.5 t80 . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.1 0.476 . . . . 0.0 110.675 -173.408 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 86.8 m . . . . . 0 CA--C 1.529 0.172 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 4.5 Cg_exo -74.29 165.22 32.34 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.628 2.218 . . . . 0.0 111.394 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -120.66 152.62 37.96 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.958 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.17 124.83 53.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.136 0.493 . . . . 0.0 110.957 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -81.65 107.06 14.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.772 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.5 mt -91.96 5.27 50.71 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.831 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -80.47 -17.44 51.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -64.68 -27.42 68.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.619 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.536 HD21 HD11 ' B' ' 504' ' ' LEU . 52.1 mt -69.98 142.69 52.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.036 -176.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -70.5 158.14 36.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.073 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.5 t -58.29 -43.1 85.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 110.145 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.99 -40.05 91.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.344 178.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 16.6 m -65.89 -42.8 89.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.107 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 91.8 mt -65.06 -42.01 94.62 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.978 0.418 . . . . 0.0 110.814 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.42 -35.93 82.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.977 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.7 ttm180 -63.66 -39.94 95.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.085 -179.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.465 ' HA ' HG13 ' B' ' 495' ' ' VAL . 54.3 t80 -60.51 -52.27 65.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.544 173.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.636 ' HG2' HD12 ' A' ' 167' ' ' LEU . 19.9 mtpp -66.35 -28.69 68.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.069 -175.142 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -80.04 -39.52 29.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.092 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -70.64 -40.67 72.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.597 0.237 . . . . 0.0 111.232 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -88.6 -0.4 57.22 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.493 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 55.99 82.37 0.11 Allowed 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.677 0.61 . . . . 0.0 111.922 176.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.636 HD12 ' HG2' ' A' ' 162' ' ' LYS . 93.2 mt -114.53 134.1 22.4 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.478 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.61 127.81 7.43 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.527 2.152 . . . . 0.0 112.254 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 10.6 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.258 178.984 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 64.2 mt . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.981 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 16.7 m120 -80.21 168.21 19.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.773 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.668 ' O ' HG23 ' A' ' 179' ' ' VAL . 17.8 tptm -55.88 -54.52 43.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.519 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.02 73.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.981 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 5.8 mm100 -69.22 -40.85 77.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.013 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 94.5 mt -59.83 -44.66 93.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.883 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 175' ' ' LYS . 37.6 t -57.67 -43.05 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.067 -178.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.03 -48.43 78.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.1 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.93 -46.27 96.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 CA-C-O 120.947 0.403 . . . . 0.0 110.687 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.7 t -59.39 -48.6 86.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.368 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.409 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -58.82 -46.76 93.05 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.376 -0.44 . . . . 0.0 112.714 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.98 -45.64 78.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.928 0.394 . . . . 0.0 111.231 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -79.48 -29.96 41.88 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.923 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.0 t80 -63.47 -43.47 97.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.787 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -68.07 -15.58 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 111.198 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 m -99.33 10.18 41.91 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.566 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.2 mt -83.26 118.98 73.23 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-O 120.651 0.262 . . . . 0.0 111.185 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.09 114.2 3.54 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.104 2.536 . . . . 0.0 110.925 173.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.03 138.28 52.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.128 0.49 . . . . 0.0 111.241 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -100.28 142.15 32.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.855 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.69 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.7 tt0 -63.59 -64.32 0.93 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 194' ' ' LYS . . . . . 0.404 ' C ' ' HD3' ' A' ' 194' ' ' LYS . 1.0 OUTLIER -64.43 -50.08 68.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.19 -171.841 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -55.62 -39.75 71.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.468 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 37.1 m -75.3 -36.81 61.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.072 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 21.8 mt -60.29 -48.13 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 176.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 63.6 m -59.19 -42.67 91.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 68.5 m -56.54 -55.79 29.41 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.187 0.518 . . . . 0.0 111.696 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.722 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 46.6 t80 -63.44 -48.03 79.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.109 -176.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 82.6 mt -57.61 -52.82 52.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -58.59 -37.67 76.31 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 33.1 m -60.66 -52.26 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.884 0.373 . . . . 0.0 110.74 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 18.9 t -76.54 -24.5 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.915 -174.117 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' A' ' 205' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.413 . . . . 0.0 110.978 177.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 2.8 p . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -61.17 -40.33 93.51 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.098 0.408 . . . . 0.0 111.063 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 68.4 m -63.12 -34.05 76.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.906 0.384 . . . . 0.0 110.486 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.64 -47.45 69.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.583 ' O ' HG23 ' B' ' 471' ' ' VAL . 74.9 t80 -52.59 -59.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.427 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.722 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 58.6 m-85 -63.55 -39.37 94.24 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -174.189 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.79 -41.41 95.84 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.991 0.424 . . . . 0.0 110.186 177.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.2 -42.32 93.66 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.326 178.101 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.583 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.9 t -60.67 -51.35 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-O 120.955 0.407 . . . . 0.0 110.204 175.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -55.04 -34.85 63.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.454 -177.548 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -87.06 -51.03 6.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.818 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -71.39 -25.54 62.4 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -172.255 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 475' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' B' ' 475' ' ' LEU . 12.1 tp -70.44 -19.76 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? 73.59 -43.39 0.55 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 124.071 0.857 . . . . 0.0 111.497 173.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 26.1 t -97.99 125.15 42.79 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.939 0.399 . . . . 0.0 111.273 -177.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -70.76 -27.8 64.2 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.806 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 479' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' B' ' 479' ' ' GLU . 2.6 mp0 -65.16 -44.24 89.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.604 176.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.589 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -65.25 -40.0 93.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.599 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.842 176.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.458 ' HG2' ' HE ' ' B' ' 486' ' ' ARG . 27.5 tt0 -58.57 -44.21 89.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.251 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.45 -40.95 98.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.699 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.65 -47.56 81.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.31 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 83.3 mt -66.07 -30.55 71.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.028 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.624 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.9 mtm105 -68.92 -38.31 79.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.804 0.335 . . . . 0.0 110.793 176.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 55.8 m -60.74 -34.09 73.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.195 0.521 . . . . 0.0 109.857 171.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.543 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.8 mt -69.11 -45.62 69.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.917 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.545 HG22 ' HA ' ' B' ' 486' ' ' ARG . 24.3 m -62.9 -44.6 99.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.102 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 43.6 pt -67.1 -30.46 49.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.941 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -62.27 -45.09 94.84 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.185 0.517 . . . . 0.0 110.31 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -73.33 -29.23 62.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.079 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -81.6 12.77 3.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.448 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 64.52 27.58 13.41 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.032 0.444 . . . . 0.0 111.148 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.571 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.6 t -87.66 -46.85 15.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.653 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.0 pt -120.02 160.96 19.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.231 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.405 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.8 t -100.77 178.44 4.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.104 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.595 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 35.1 ttp180 -54.44 -52.39 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -50.97 -52.91 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.66 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.449 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.2 mp0 -58.29 -47.41 83.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.999 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.6 tp -55.29 -45.64 76.21 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.071 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.562 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 58.2 t -63.52 -38.54 82.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.965 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -74.99 -38.22 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.685 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.536 HD11 HD21 ' A' ' 153' ' ' LEU . 90.1 mt -62.33 -37.16 84.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.785 0.326 . . . . 0.0 111.813 -176.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.454 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -88.78 2.77 6.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.03 0.443 . . . . 0.0 111.183 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.539 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 28.2 t -59.07 -49.23 94.27 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.084 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 51.5 Cg_exo -55.91 -23.93 45.28 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 121.785 1.657 . . . . 0.0 112.571 176.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -87.88 -64.57 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.029 -177.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.668 HD22 HD23 ' B' ' 515' ' ' LEU . 64.7 mt -89.47 3.07 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.785 -172.563 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.43 -27.46 70.84 Favored Glycine 0 N--CA 1.453 -0.174 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.488 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -87.02 1.35 53.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.754 0.311 . . . . 0.0 110.801 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -125.3 85.5 58.27 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.971 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.19 -54.88 3.99 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.154 2.569 . . . . 0.0 113.56 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -62.88 -31.88 73.02 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 111.376 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.668 HD23 HD22 ' B' ' 509' ' ' LEU . 20.9 tp -76.67 -42.04 43.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.281 0.562 . . . . 0.0 110.218 -177.12 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.441 ' HD1' ' HB2' ' B' ' 509' ' ' LEU . 32.1 t80 -70.97 -34.37 71.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.092 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -71.58 -30.51 65.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.724 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -61.44 -48.1 82.68 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.562 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 34.6 t80 -54.96 -43.24 73.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.357 177.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.422 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.3 mttt -62.52 -46.46 88.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.109 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -60.36 -42.17 95.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.756 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -66.7 -41.21 88.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 -176.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.595 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 9.5 mp -82.75 -4.6 58.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.667 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 63.88 37.18 94.28 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.261 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 60.1 t80 . . . . . 0 N--CA 1.448 -0.54 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.084 -175.764 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 C--O 1.233 0.216 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.426 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 45.0 Cg_endo -73.49 155.39 50.4 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 121.893 1.729 . . . . 0.0 110.845 174.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -129.58 157.4 42.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.903 0.382 . . . . 0.0 111.246 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 148' ' ' VAL . . . . . 0.405 HG11 ' CE2' ' A' ' 186' ' ' PHE . 4.1 p -97.42 125.11 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.726 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 151' ' ' TYR . 18.4 p-10 -94.43 96.62 9.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.344 0.593 . . . . 0.0 109.756 176.462 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.689 HD23 HD11 ' B' ' 504' ' ' LEU . 92.6 mt -71.48 25.27 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.435 ' CD1' HG21 ' A' ' 179' ' ' VAL . 3.3 t80 -96.57 -4.81 40.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 120.958 0.409 . . . . 0.0 109.994 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.65 -24.14 29.17 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.715 HD21 HD13 ' B' ' 504' ' ' LEU . 79.4 mt -62.63 135.52 57.42 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.231 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -74.98 163.26 27.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.405 177.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.91 -35.73 41.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.49 -44.89 95.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.767 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.449 HG23 ' HA ' ' B' ' 496' ' ' ILE . 8.4 m -69.65 -42.41 74.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.085 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.8 mt -61.25 -43.46 98.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.394 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -66.17 -34.86 78.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.74 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.673 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 34.7 ttm180 -68.16 -45.75 72.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.14 -178.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.41 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 48.4 t80 -52.89 -51.6 60.57 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.474 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 10.2 mtpm? -59.95 -38.83 83.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.024 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -76.66 -44.97 31.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.242 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -70.04 -30.9 68.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.601 0.238 . . . . 0.0 111.002 -176.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.528 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 62.6 m-85 -96.15 0.3 51.08 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.185 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.61 75.22 0.34 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.741 0.651 . . . . 0.0 111.846 178.271 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 89.2 mt -110.18 106.82 58.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.906 177.172 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 32.0 Cg_endo -65.26 125.7 15.01 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.347 2.031 . . . . 0.0 111.784 -178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.525 HG21 HD13 ' A' ' 181' ' ' ILE . 20.3 p . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.98 -175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.9 mt . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.138 0.494 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.783 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 16.3 t-20 -145.3 169.08 18.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.47 ' HE3' ' O ' ' A' ' 153' ' ' LEU . 22.3 tptm -50.66 -49.64 56.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.751 0.31 . . . . 0.0 110.4 176.138 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 176' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -63.24 -40.43 97.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.119 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.783 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 62.3 mm-40 -62.57 -46.92 86.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.551 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 83.1 mt -61.21 -43.22 99.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.537 -178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.435 HG21 ' CD1' ' A' ' 151' ' ' TYR . 57.1 t -60.37 -43.34 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.221 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.9 mt-10 -64.18 -41.75 96.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.906 0.384 . . . . 0.0 110.954 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.525 HD13 HG21 ' A' ' 169' ' ' THR . 81.3 mt -68.65 -50.88 51.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.822 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.554 HG12 HD13 ' A' ' 150' ' ' LEU . 77.9 t -58.44 -45.69 89.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.082 177.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 183' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' A' ' 187' ' ' LYS . . . -62.2 -42.05 99.72 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.733 -178.464 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.72 -45.55 93.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.83 0.348 . . . . 0.0 110.555 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -77.24 -29.92 54.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.704 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.405 ' CE2' HG11 ' A' ' 148' ' ' VAL . 45.2 t80 -63.07 -30.64 71.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.635 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 183' ' ' GLY . 72.8 mmtt -67.67 -12.51 60.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.659 178.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 17.0 m -133.87 59.62 1.73 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.067 0.46 . . . . 0.0 111.252 -176.246 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.802 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 67.8 mt -105.79 119.14 53.43 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.782 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.94 126.86 14.39 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.869 2.379 . . . . 0.0 111.17 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -142.15 131.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.103 0.478 . . . . 0.0 111.537 -175.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -109.36 125.44 52.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.938 177.268 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.6 tt0 -49.32 -62.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -172.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 194' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 194' ' ' LYS . 38.0 ttpt -55.89 -60.25 3.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.54 -42.01 64.02 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.115 0.483 . . . . 0.0 111.376 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 56.9 m -68.72 -41.05 79.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.188 -176.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 60.5 mt -66.11 -48.7 70.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.341 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.1 m -56.34 -46.49 79.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.755 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 199' ' ' CYS . . . . . 0.575 ' HA ' ' CE2' ' A' ' 202' ' ' TYR . 71.2 m -62.2 -48.85 78.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.246 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.585 ' CD1' HD22 ' B' ' 488' ' ' LEU . 82.6 t80 -60.38 -49.29 78.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.861 0.362 . . . . 0.0 110.633 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.49 HD11 ' HE2' ' B' ' 468' ' ' PHE . 61.9 mt -58.0 -52.17 61.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.769 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 202' ' ' TYR . . . . . 0.575 ' CE2' ' HA ' ' A' ' 199' ' ' CYS . 2.2 p90 -69.45 -35.3 75.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.915 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 44.8 m -64.93 -50.99 64.29 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.755 0.312 . . . . 0.0 110.629 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.426 HG21 ' CE1' ' A' ' 200' ' ' PHE . 47.0 t -69.58 -25.58 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.929 -176.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 201' ' ' ILE . 33.6 mtp180 . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 120.775 0.321 . . . . 0.0 111.338 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.692 0.282 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' B' ' 464' ' ' GLU . 32.0 mp0 -64.95 -48.08 75.36 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 3.6 m -63.19 -35.92 81.9 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.863 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 59.5 tp -60.41 -49.13 78.79 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.413 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.551 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.0 t80 -53.43 -57.68 9.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.42 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.49 ' HE2' HD11 ' A' ' 201' ' ' ILE . 54.5 m-85 -62.52 -33.6 75.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.508 -175.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.83 -44.76 84.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.231 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -67.73 -32.45 73.07 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.22 176.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 467' ' ' PHE . 76.2 t -59.85 -50.65 79.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.002 0.429 . . . . 0.0 109.935 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 472' ' ' ARG . . . . . 0.435 ' HG3' ' CE1' ' B' ' 481' ' ' TYR . 4.7 mtt-85 -56.28 -49.61 73.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.591 175.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -65.44 -41.38 93.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.049 -175.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -81.64 -40.7 22.52 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -68.39 -39.08 81.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.99 -178.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 71.03 -47.56 0.66 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.72 0.637 . . . . 0.0 111.884 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 27.3 t -72.92 130.54 40.62 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.98 0.419 . . . . 0.0 110.535 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.0 69.79 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.814 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -75.04 -34.28 61.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.53 -42.49 74.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 177.321 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' B' ' 472' ' ' ARG . 60.0 t80 -63.73 -40.49 96.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.066 175.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 30.2 tt0 -65.09 -38.16 89.84 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.87 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 13.9 t-20 -55.35 -47.6 75.51 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.967 174.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 85.8 t80 -53.6 -44.39 69.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.937 176.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.536 ' HB3' HG21 ' A' ' 191' ' ' VAL . 83.1 mt -69.98 -28.96 65.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.383 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.802 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 21.6 mmt85 -63.2 -49.28 74.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.512 0.673 . . . . 0.0 109.335 174.549 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.6 m -57.8 -35.76 71.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.216 176.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.585 HD22 ' CD1' ' A' ' 200' ' ' PHE . 24.8 mt -65.79 -54.45 26.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.309 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.6 m -58.64 -42.53 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.92 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.528 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 20.8 pt -70.6 -31.32 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.881 -0.728 . . . . 0.0 111.161 179.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.22 -37.54 75.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.588 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.81 -30.44 71.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.265 0.555 . . . . 0.0 110.075 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.56 1.02 50.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.327 175.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 56.52 36.94 28.37 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.185 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.673 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.8 t -78.6 -46.24 24.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.408 174.258 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.449 ' HA ' HG23 ' A' ' 157' ' ' THR . 39.8 pt -102.9 141.67 18.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.721 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.548 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 8.0 m -81.76 179.21 7.92 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.558 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.577 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.4 ttm180 -60.21 -57.87 10.97 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.823 -0.172 . . . . 0.0 110.629 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.96 70.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.018 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.548 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 19.8 mm-40 -61.14 -49.97 75.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.521 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.488 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 61.5 tp -59.35 -45.74 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.879 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.577 HG23 ' O ' ' B' ' 498' ' ' ARG . 57.6 t -61.06 -40.7 86.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.186 -178.176 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -82.84 -22.41 34.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 153' ' ' LEU . 11.5 tp -67.31 -49.88 62.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.525 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.55 HG22 ' HB2' ' B' ' 508' ' ' PHE . 9.8 p -86.18 13.05 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.55 -176.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.537 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 22.8 t -57.19 -45.07 99.96 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' B' ' 506' ' ' SER . 11.7 Cg_endo -59.24 -17.95 42.12 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.287 1.991 . . . . 0.0 113.009 174.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.55 ' HB2' HG22 ' B' ' 505' ' ' VAL . 27.4 m-85 -105.71 149.12 26.69 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.422 HD22 HD23 ' B' ' 515' ' ' LEU . 71.9 mt 68.56 -17.73 0.18 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 177.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 510' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' B' ' 508' ' ' PHE . . . -65.89 -15.03 61.89 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.501 -0.381 . . . . 0.0 113.295 -176.411 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.451 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.8 mptp? -85.09 -10.39 56.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.109 0.481 . . . . 0.0 109.779 177.161 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -123.2 92.96 48.61 Favored Pre-proline 0 C--O 1.235 0.334 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.95 -175.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.05 -53.53 6.99 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.316 2.677 . . . . 0.0 113.564 -174.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -57.91 -37.42 74.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 111.948 -176.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 509' ' ' LEU . 15.6 tp -79.48 -43.35 23.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.575 -171.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.465 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 0.6 OUTLIER -70.88 -28.41 64.53 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.141 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -67.73 -42.99 81.01 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -53.32 -48.58 68.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.488 ' HZ ' ' HG ' ' B' ' 501' ' ' LEU . 43.0 t80 -55.68 -52.41 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.137 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 58.2 mttp -59.76 -40.39 88.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.94 0.4 . . . . 0.0 111.076 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -69.66 -32.78 71.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.534 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.42 ' CZ ' ' HG3' ' A' ' 205' ' ' ARG . 54.5 t80 -82.41 -31.91 29.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.736 0.779 . . . . 0.0 108.972 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.557 HD23 HG22 ' B' ' 502' ' ' VAL . 15.4 tp -81.76 -10.18 59.43 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.904 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.74 39.24 96.43 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.324 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 62.2 t80 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 120.907 0.384 . . . . 0.0 110.552 -178.495 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.609 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 52.6 Cg_exo -56.55 151.12 47.99 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.761 2.307 . . . . 0.0 112.385 178.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -104.84 142.24 35.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.371 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.97 106.22 19.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.412 0.625 . . . . 0.0 110.316 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -65.56 114.04 4.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.93 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.438 ' HB2' HG13 ' A' ' 179' ' ' VAL . 77.8 mt -100.1 -0.11 39.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.243 0.544 . . . . 0.0 110.369 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -75.3 -20.84 58.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.183 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.443 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 3.0 pt20 -70.29 -25.97 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.457 178.036 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.44 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -68.29 161.29 27.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.327 0.584 . . . . 0.0 111.29 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.39 158.11 30.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.251 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.416 HG13 ' CD1' ' A' ' 178' ' ' LEU . 51.7 t -59.13 -44.77 92.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.159 0.504 . . . . 0.0 109.658 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 156' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 86.5 m-20 -62.09 -35.28 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.082 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 41.4 m -67.36 -45.82 75.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.842 0.353 . . . . 0.0 110.824 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.98 -40.17 90.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.198 0.523 . . . . 0.0 110.802 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 163' ' ' ARG . 94.5 mtt180 -67.03 -37.24 83.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.347 175.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.8 ttm180 -61.46 -45.0 96.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.079 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -53.33 -50.28 65.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.091 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HD3' ' CG2' ' A' ' 169' ' ' THR . 47.5 mttp -58.64 -45.49 89.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.144 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 159' ' ' ARG . 30.8 mmm180 -72.56 -39.29 67.56 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.407 -175.462 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -71.94 -33.72 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 111.344 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.406 ' CE1' HG22 ' B' ' 490' ' ' ILE . 40.4 m-85 -93.29 3.11 56.18 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.421 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt 61.56 48.95 5.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.764 173.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.493 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 85.7 mt -92.55 134.09 28.51 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.134 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.493 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 14.6 Cg_exo -69.39 127.32 14.71 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.032 2.488 . . . . 0.0 111.808 176.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.56 ' HB ' HD11 ' A' ' 173' ' ' LEU . 16.6 p . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 121.056 0.455 . . . . 0.0 111.352 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.56 HD11 ' HB ' ' A' ' 169' ' ' THR . 85.8 mt . . . . . 0 C--O 1.233 0.226 0 CA-C-O 121.418 0.628 . . . . 0.0 111.634 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.488 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 11.1 t-20 -136.06 159.93 40.2 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.588 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.65 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.3 tptm -48.16 -54.31 13.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.289 0.368 . . . . 0.0 111.425 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 176' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -61.1 -37.47 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.113 -178.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.488 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 85.3 mm-40 -63.92 -40.96 97.7 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.377 0.608 . . . . 0.0 110.068 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.476 ' O ' HG23 ' A' ' 182' ' ' VAL . 87.9 mt -61.16 -49.77 75.89 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 177.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 175' ' ' LYS . 19.0 t -56.92 -47.06 83.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 O-C-N 123.777 0.673 . . . . 0.0 111.034 -178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.0 mt-10 -58.7 -50.11 75.1 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.3 mt -61.96 -39.0 82.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.858 0.361 . . . . 0.0 110.761 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.606 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 71.9 t -64.02 -49.56 81.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.707 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.43 -33.71 85.61 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.473 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.03 -49.12 79.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.824 0.345 . . . . 0.0 110.298 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -83.57 -23.53 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.056 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.3 t80 -58.54 -40.67 83.61 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.88 0.472 . . . . 0.0 110.67 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.78 0.23 27.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.87 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -107.25 13.77 26.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.809 0.338 . . . . 0.0 111.027 -179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.717 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 74.7 mt -90.89 116.61 66.79 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.899 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.4 112.09 3.45 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.657 2.238 . . . . 0.0 111.345 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.0 p -120.11 137.2 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -108.23 136.38 47.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.178 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -58.25 -61.87 2.25 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -55.98 -55.81 28.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.624 -176.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.09 -49.24 69.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.9 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 38.9 m -69.32 -44.94 70.68 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.402 HD11 ' OH ' ' B' ' 481' ' ' TYR . 56.4 mt -60.12 -41.52 92.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.92 0.39 . . . . 0.0 110.129 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 54.4 m -58.93 -47.55 84.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.86 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.87 -45.97 92.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.575 ' CD1' HD22 ' B' ' 488' ' ' LEU . 65.6 t80 -61.43 -58.86 6.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.312 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.533 HD11 ' HE2' ' B' ' 468' ' ' PHE . 67.8 mt -56.38 -43.41 77.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.025 0.441 . . . . 0.0 110.707 -175.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -62.52 -46.38 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.179 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 21.3 m -68.71 -39.94 80.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.678 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 200' ' ' PHE . 21.6 t -75.69 -25.78 17.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.867 0.365 . . . . 0.0 111.099 -176.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 205' ' ' ARG . 13.3 mtp180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 110.553 173.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.1 t . . . . . 0 CA--C 1.531 0.219 0 CA-C-O 120.863 0.364 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.412 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 7.2 mp0 -66.68 -52.66 42.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 178.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.0 t -63.01 -34.06 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.885 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 42.2 tp -59.24 -50.85 72.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.829 175.248 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.525 ' O ' HG23 ' B' ' 471' ' ' VAL . 68.5 t80 -52.91 -52.45 57.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.72 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.533 ' HE2' HD11 ' A' ' 201' ' ' ILE . 35.2 m-85 -62.87 -36.51 83.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -176.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.27 -39.01 86.0 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 470' ' ' LYS . . . . . 0.505 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 64.0 mttm -59.85 -49.65 76.86 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.397 174.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.601 HG13 HD21 ' B' ' 509' ' ' LEU . 64.2 t -55.95 -48.0 79.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 121.334 0.587 . . . . 0.0 110.302 177.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -59.59 -33.67 71.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.05 -177.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -86.26 -50.18 7.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.415 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -67.76 -32.4 72.96 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.86 -21.04 66.03 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 64.93 0.43 1.2 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -134.82 129.98 35.35 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.915 0.388 . . . . 0.0 110.86 -177.511 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.03 -39.23 90.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.364 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.12 -31.51 72.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.96 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.609 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.78 -47.19 79.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 75.8 t80 -65.75 -35.9 82.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.832 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 482' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.29 -38.03 89.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.442 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' B' ' 486' ' ' ARG . 7.1 t30 -72.78 -30.99 64.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.12 0.486 . . . . 0.0 110.323 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 68.4 t80 -60.48 -50.48 73.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.314 0.578 . . . . 0.0 109.471 171.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 75.5 mt -64.83 -29.1 70.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.457 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.717 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 2.4 tpp85 -60.19 -49.11 78.9 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.861 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 37.9 m -63.04 -31.13 72.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.57 175.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 200' ' ' PHE . 33.6 mt -68.88 -45.19 71.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.585 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.2 m -65.83 -40.73 88.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.264 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.553 HD13 ' HE1' ' A' ' 186' ' ' PHE . 39.9 pt -67.84 -32.44 56.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 119.689 -0.804 . . . . 0.0 110.487 177.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -63.93 -43.03 97.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.251 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -63.5 -29.64 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.186 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 493' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 79.3 mt-30 -95.17 17.84 13.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.799 -177.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 59.95 27.15 16.48 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.407 0.683 . . . . 0.0 112.056 177.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.522 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 88.0 t -78.21 -41.56 26.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.303 0.573 . . . . 0.0 109.606 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 48.1 pt -124.68 154.17 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.819 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.3 t -102.94 -169.4 1.65 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.515 ' O ' HG23 ' B' ' 502' ' ' VAL . 19.5 ttm180 -55.54 -55.48 31.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.442 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -54.01 -50.45 66.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.486 -176.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.545 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 2.4 mp0 -59.91 -46.31 89.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.118 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.422 HD23 HD21 ' B' ' 523' ' ' LEU . 65.2 tp -57.83 -44.7 86.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.918 0.39 . . . . 0.0 111.114 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.64 HG22 HD23 ' B' ' 523' ' ' LEU . 59.7 t -67.79 -36.39 75.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.443 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 70.1 mt-30 -77.27 -35.11 55.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.266 -177.048 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 91.1 mt -65.7 -37.71 87.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 0.0 111.503 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.7 p -87.11 6.7 2.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.967 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.6 t -59.01 -49.2 94.62 Favored Pre-proline 0 CA--C 1.542 0.638 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.741 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 36.8 Cg_exo -63.06 -6.38 9.51 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.228 1.952 . . . . 0.0 113.132 177.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.479 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 68.3 m-85 -108.4 -66.02 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.665 -178.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.601 HD21 HG13 ' B' ' 471' ' ' VAL . 82.4 mt -90.99 -13.15 33.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.72 -12.06 66.81 Favored Glycine 0 C--O 1.23 -0.109 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.077 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -80.15 -13.66 59.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.352 0.596 . . . . 0.0 109.8 176.866 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.76 89.47 47.84 Favored Pre-proline 0 N--CA 1.451 -0.416 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.809 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 513' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' B' ' 517' ' ' ASN . 74.4 Cg_exo -51.88 -35.94 61.68 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.319 2.679 . . . . 0.0 113.313 -177.009 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.18 -48.64 50.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.275 0.559 . . . . 0.0 110.408 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.524 HD23 HD22 ' B' ' 509' ' ' LEU . 18.0 tp -67.07 -38.8 86.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.475 0.655 . . . . 0.0 110.044 -178.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -67.29 -32.33 73.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.031 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 517' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' B' ' 513' ' ' PRO . 0.2 OUTLIER -64.75 -40.46 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.821 176.721 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.412 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 9.7 t90 -58.65 -49.22 78.31 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.553 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 18.2 t80 -56.95 -46.08 82.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.909 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.66 -37.05 85.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.172 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -65.34 -38.91 91.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.438 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -82.42 -35.02 28.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.562 0.696 . . . . 0.0 109.745 -175.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.64 HD23 HG22 ' B' ' 502' ' ' VAL . 11.8 tp -85.31 -24.9 27.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.367 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 88.87 26.99 25.22 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.638 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 53.8 t80 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 120.844 0.354 . . . . 0.0 110.272 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 C--O 1.234 0.278 0 CA-C-O 120.757 0.313 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 7.4 Cg_exo -70.81 147.23 55.65 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.305 2.003 . . . . 0.0 111.064 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -107.92 152.44 24.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.892 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 5.5 p -99.6 121.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.148 0.499 . . . . 0.0 110.348 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -77.57 121.09 23.43 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 504' ' ' LEU . 85.3 mt -109.38 8.27 25.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.153 0.501 . . . . 0.0 110.616 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -90.8 -25.94 19.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.446 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.472 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 25.6 pt20 -63.71 -26.42 68.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.458 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' B' ' 500' ' ' GLU . 63.7 mt -66.31 161.8 21.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.404 -177.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -79.15 154.63 29.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.606 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.566 HG13 ' CD1' ' A' ' 178' ' ' LEU . 37.0 t -61.31 -39.25 82.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.808 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 5.6 p30 -64.66 -30.01 71.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.541 0.21 . . . . 0.0 110.479 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 17.2 m -68.9 -45.96 69.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.127 0.489 . . . . 0.0 110.395 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.4 mt -65.28 -41.3 94.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.713 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 163' ' ' ARG . 82.8 mtp180 -66.35 -33.36 75.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.455 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 18.3 ttm180 -65.41 -44.71 86.57 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.548 ' HA ' HG13 ' B' ' 495' ' ' VAL . 68.0 t80 -55.74 -50.16 71.13 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.552 174.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.457 ' NZ ' HG21 ' A' ' 181' ' ' ILE . 21.3 mtpp -64.66 -38.71 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.442 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 81.8 mtp180 -76.9 -34.77 57.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.764 0.316 . . . . 0.0 110.738 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -69.85 -47.68 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -85.06 -1.89 57.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.443 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm 58.49 81.36 0.16 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.722 0.639 . . . . 0.0 111.129 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.43 HD12 ' HG2' ' A' ' 162' ' ' LYS . 82.4 mt -116.19 100.53 53.56 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.626 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.47 141.72 89.86 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.263 2.642 . . . . 0.0 111.978 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.417 ' CG2' HD11 ' A' ' 173' ' ' LEU . 4.1 t . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.712 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.417 HD11 ' CG2' ' A' ' 169' ' ' THR . 83.5 mt . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.233 0.54 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -120.09 -175.56 3.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.726 176.322 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.669 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.6 tptm -58.87 -58.37 8.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.233 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.28 69.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 0.0 111.359 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -59.96 -50.45 73.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.306 0.574 . . . . 0.0 110.739 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.566 ' CD1' HG13 ' A' ' 155' ' ' VAL . 68.1 mt -60.51 -43.65 96.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.9 t -57.85 -45.76 87.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.972 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.62 -46.6 89.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.08 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.457 HG21 ' NZ ' ' A' ' 162' ' ' LYS . 63.1 mt -65.4 -45.72 92.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.3 t -60.74 -49.54 84.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.787 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.13 -38.56 95.8 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.169 -0.538 . . . . 0.0 112.235 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.21 -51.55 69.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.575 0.226 . . . . 0.0 110.772 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -80.83 -24.5 38.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.744 0.307 . . . . 0.0 111.183 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.444 ' CE1' HD13 ' B' ' 490' ' ' ILE . 15.5 t80 -61.48 -44.64 96.74 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.452 -178.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -82.37 22.6 0.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 111.416 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -126.99 22.58 6.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.169 0.509 . . . . 0.0 110.143 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.714 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.9 mt -97.72 118.83 63.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.183 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 190' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 7.1 Cg_exo -72.93 113.48 3.78 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 122.969 2.446 . . . . 0.0 110.807 174.305 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.7 p -119.49 156.43 21.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.877 0.37 . . . . 0.0 111.18 -172.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 192' ' ' ASN . . . . . 0.501 ' O ' ' HB ' ' A' ' 196' ' ' THR . 92.3 m-20 -107.71 147.84 30.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.093 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.7 tt0 -72.28 -66.4 0.65 Allowed 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.597 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -73.43 -45.25 55.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.495 -172.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.76 -42.74 99.82 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.158 -176.192 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 196' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 192' ' ' ASN . 99.4 m -72.68 -38.03 67.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.359 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 37.6 mt -57.69 -51.01 71.28 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 19.5 m -58.49 -44.73 89.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.623 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.2 t -55.06 -54.72 39.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.361 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.593 ' CD1' HD22 ' B' ' 488' ' ' LEU . 70.0 t80 -57.79 -48.65 79.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.616 -177.569 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 197' ' ' LEU . 91.7 mt -54.89 -51.7 50.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.944 -178.025 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -67.42 -30.73 70.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.741 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.8 m -63.64 -52.03 62.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 0.0 110.931 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.7 t -68.63 -27.67 37.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.166 0.508 . . . . 0.0 110.264 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.4 ' HD3' HG22 ' A' ' 201' ' ' ILE . 68.8 mtp180 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.362 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.238 0.453 0 CA-C-O 121.193 0.52 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' B' ' 464' ' ' GLU . 1.9 mp0 -58.81 -36.83 75.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.906 174.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.3 t -60.01 -39.49 85.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.839 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.415 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 59.9 tp -60.56 -49.07 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.065 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 467' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -53.73 -54.92 31.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.777 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.478 ' HE2' HD11 ' A' ' 201' ' ' ILE . 38.6 m-85 -65.32 -33.56 76.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.73 -175.334 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.53 -42.76 98.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.982 0.42 . . . . 0.0 110.133 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 65.8 mttm -58.42 -51.29 70.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.27 174.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . 93.8 t -57.07 -44.35 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.95 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -58.03 -37.44 74.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.382 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -86.86 -38.42 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.979 0.419 . . . . 0.0 111.351 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -65.88 -49.19 68.98 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 -174.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.75 -31.14 72.22 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.216 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 69.32 -59.47 0.48 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.951 0.782 . . . . 0.0 111.986 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -64.42 130.8 45.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.43 78.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.326 176.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -69.63 -39.27 77.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.62 -44.39 82.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.156 177.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 485' ' ' LEU . 84.5 t80 -64.91 -41.14 95.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.931 0.396 . . . . 0.0 110.045 177.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.2 tt0 -60.07 -43.42 95.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.547 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.6 -45.26 89.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.811 178.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.491 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 63.3 t80 -54.33 -48.78 70.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.359 174.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.422 HD11 ' CE2' ' B' ' 481' ' ' TYR . 82.9 mt -63.88 -34.7 78.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.943 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.714 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 18.9 mtt85 -66.23 -36.98 84.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.744 0.307 . . . . 0.0 110.339 176.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.37 -34.27 75.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.488 . . . . 0.0 109.752 174.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.593 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.7 mt -68.23 -45.14 74.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.453 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' B' ' 486' ' ' ARG . 14.9 m -67.14 -42.5 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.694 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.444 HD13 ' CE1' ' A' ' 186' ' ' PHE . 28.0 pt -68.54 -31.18 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.515 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.2 -43.91 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.146 173.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.3 -37.33 85.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.199 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.8 16.0 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.772 -176.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 67.35 10.95 8.11 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 122.608 0.363 . . . . 0.0 111.665 177.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 161' ' ' TYR . 77.2 t -70.91 -42.46 77.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 111.61 -174.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 45.3 pt -117.56 151.25 19.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.732 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.709 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 13.5 m -75.49 160.03 30.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' B' ' 501' ' ' LEU . 16.5 ttp180 -67.48 -36.54 81.32 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.802 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -64.54 -43.95 92.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.349 . . . . 0.0 110.333 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.717 ' HB3' HD22 ' A' ' 153' ' ' LEU . 9.3 mm-40 -55.86 -38.8 70.6 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.656 176.077 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.433 ' HB3' ' O ' ' B' ' 498' ' ' ARG . 60.2 tp -61.58 -49.78 75.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.471 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.604 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.4 OUTLIER -59.21 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.176 0.512 . . . . 0.0 109.791 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 503' ' ' GLN . . . . . 0.472 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 44.9 mt-30 -66.51 -42.0 87.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.806 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.551 HD21 HD11 ' A' ' 153' ' ' LEU . 50.2 mt -61.02 -41.97 97.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.878 0.37 . . . . 0.0 111.544 -178.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -87.09 4.06 4.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.016 -178.324 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.513 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 33.7 t -58.83 -48.39 96.91 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.944 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 52.7 Cg_exo -56.73 -20.66 36.04 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.808 1.672 . . . . 0.0 112.734 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.434 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 72.8 m-85 -96.66 -60.59 1.57 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.182 -175.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.711 ' HG ' HG22 ' B' ' 505' ' ' VAL . 55.6 mt -84.61 -19.84 32.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.077 -175.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.16 -8.92 52.66 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.316 -0.468 . . . . 0.0 112.344 -179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -73.31 -21.58 60.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 174.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.643 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 31.8 m-85 -128.0 101.96 22.31 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.86 -49.55 16.57 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.124 2.549 . . . . 0.0 112.704 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -56.9 -43.9 81.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 0.0 111.336 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.58 -44.58 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.998 -174.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 7.9 t80 -70.34 -29.94 66.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.429 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -67.27 -42.26 84.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.842 176.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -54.96 -48.52 73.1 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.484 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.529 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 29.5 t80 -56.45 -51.38 68.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.967 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.457 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 99.2 mttt -59.53 -34.98 73.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.855 0.359 . . . . 0.0 110.917 178.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -66.69 -35.33 79.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.013 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -78.91 -34.09 44.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.22 0.533 . . . . 0.0 110.367 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.451 ' CD2' HG22 ' B' ' 502' ' ' VAL . 11.0 mp -80.7 -16.26 54.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.401 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 69.85 37.11 75.0 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.287 -175.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 14.1 t80 . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 121.111 0.481 . . . . 0.0 110.446 -176.361 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 N--CA 1.451 -0.408 0 CA-C-O 121.176 0.512 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.639 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 31.6 Cg_exo -58.86 152.63 56.19 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.707 2.271 . . . . 0.0 111.756 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -123.53 135.65 54.13 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 -174.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.1 p -96.23 124.77 49.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.315 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 50.9 m-20 -86.39 110.82 19.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.25 176.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' LEU . . . . . 0.436 HD13 HG12 ' A' ' 182' ' ' VAL . 65.8 mt -90.68 -3.84 57.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.423 0.63 . . . . 0.0 109.885 177.109 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -77.1 -11.16 59.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.36 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 152' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 29.7 pt20 -90.63 -9.38 47.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.291 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.8 mt -77.08 166.06 23.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.2 0.524 . . . . 0.0 111.649 -175.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 154' ' ' GLN . . . . . 0.437 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 90.5 mt-30 -71.97 154.84 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.343 176.068 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.94 -42.56 93.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.615 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -68.34 -31.55 71.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.364 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.437 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 10.0 m -66.12 -42.39 89.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.264 0.554 . . . . 0.0 110.469 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 75.7 mt -65.49 -41.62 93.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.249 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.66 -39.21 93.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.248 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.425 ' HG3' ' HA ' ' B' ' 495' ' ' VAL . 27.2 tpt180 -56.88 -52.89 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.477 177.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -52.34 -52.28 54.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.06 176.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.58 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 58.6 mtpt -65.37 -31.5 72.64 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.598 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.71 -47.85 20.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.605 0.24 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 164' ' ' HIS . . . . . 0.431 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 16.0 t-80 -70.09 -35.98 74.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.791 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.452 ' CE1' HG22 ' B' ' 490' ' ' ILE . 59.0 m-85 -88.86 6.38 39.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.626 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt 56.76 51.42 10.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.73 175.289 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 90.7 mt -91.76 131.49 35.56 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.575 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 36.0 Cg_exo -59.84 150.16 79.25 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.936 2.424 . . . . 0.0 111.855 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.644 -177.746 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 61.9 mt . . . . . 0 CA--C 1.516 -0.349 0 CA-C-O 121.409 0.623 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.528 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 17.1 t-20 -137.48 166.6 23.47 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.076 -0.965 . . . . 0.0 108.671 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.612 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.8 tptm -50.3 -53.12 30.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.358 0.411 . . . . 0.0 110.699 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 176' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.79 -40.61 88.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.445 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 24.6 mm-40 -60.05 -46.2 90.31 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.487 0.66 . . . . 0.0 110.257 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 77.2 mt -60.73 -51.13 70.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.171 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 175' ' ' LYS . 46.3 t -57.28 -43.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.275 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 180' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 47.6 mt-10 -58.74 -55.57 33.4 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.283 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 181' ' ' ILE . . . . . 0.58 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 63.8 mt -63.22 -42.24 95.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.607 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 47.2 t -58.66 -49.73 81.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.231 177.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 183' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -64.57 -37.24 94.15 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.131 -0.556 . . . . 0.0 112.247 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.1 t -56.67 -48.1 78.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.741 0.305 . . . . 0.0 110.651 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -83.58 -24.73 31.4 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.752 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 54.4 t80 -60.9 -34.28 74.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 187' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 64.4 mttm -81.69 -1.03 45.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.896 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.4 t -130.96 45.63 2.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 110.285 -175.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.716 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 64.2 mt -103.16 115.1 64.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.677 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.36 110.1 1.51 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.349 2.033 . . . . 0.0 111.131 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.449 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.6 p -134.18 128.66 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.067 0.461 . . . . 0.0 111.165 -174.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -104.42 126.45 51.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.097 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 38.5 tt0 -49.69 -65.21 0.6 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -172.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -58.44 -50.04 75.14 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -60.45 -41.6 94.42 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.934 -179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 66.8 m -66.78 -41.6 87.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 27.5 mt -58.31 -49.22 77.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.559 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -57.2 -47.24 81.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.04 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 78.2 m -58.46 -54.85 42.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.074 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.495 ' CG ' HD22 ' B' ' 488' ' ' LEU . 92.6 t80 -60.94 -47.09 88.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.225 -176.021 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.439 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 73.0 mt -57.58 -53.49 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.185 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -70.82 -22.66 62.31 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.287 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 72.3 m -67.57 -50.81 56.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.652 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 37.4 t -73.73 -25.06 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 111.068 -177.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 12.2 mmm180 . . . . . 0 N--CA 1.464 0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.138 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.12 -52.01 67.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.963 0.411 . . . . 0.0 109.958 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.1 m -62.26 -34.54 76.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.444 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.01 -48.81 78.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.349 177.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.554 ' O ' HG23 ' B' ' 471' ' ' VAL . 61.3 t80 -52.5 -55.72 20.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.834 176.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.534 ' CD1' HD22 ' A' ' 197' ' ' LEU . 79.2 m-85 -65.04 -32.78 74.67 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -174.396 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -63.19 -41.81 99.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.127 0.489 . . . . 0.0 109.897 174.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -68.36 -33.66 74.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.85 176.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 467' ' ' PHE . 97.2 t -61.47 -49.22 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 177.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -62.77 -35.15 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.151 0.5 . . . . 0.0 109.869 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -76.27 -23.85 54.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.467 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -88.42 -54.98 3.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.355 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.61 -44.35 96.53 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 68.46 -56.95 0.5 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.011 0.819 . . . . 0.0 112.588 173.964 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 477' ' ' SER . . . . . 0.452 ' HB3' ' HB3' ' B' ' 480' ' ' ALA . 21.8 t -59.11 137.96 57.75 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.798 0.439 . . . . 0.0 110.802 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -60.32 -55.92 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.309 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.93 -32.82 72.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.639 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -68.77 -50.97 46.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.473 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.27 -37.43 85.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.992 0.425 . . . . 0.0 110.328 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.711 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 26.4 tt0 -67.21 -34.54 77.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.77 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 483' ' ' ASN . . . . . 0.408 ' HA ' ' CG ' ' B' ' 486' ' ' ARG . 3.5 t30 -59.94 -43.4 94.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.434 175.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.1 -45.33 79.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.08 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.3 mt -66.51 -29.52 69.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.116 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.716 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 17.6 mmt85 -60.46 -46.25 90.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 174.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.7 m -61.97 -34.94 77.06 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.667 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.495 HD22 ' CG ' ' A' ' 200' ' ' PHE . 38.8 mt -66.61 -49.37 66.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.525 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 9.7 m -64.71 -42.01 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.672 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.452 HG22 ' CE1' ' A' ' 165' ' ' PHE . 12.1 pt -69.91 -31.11 46.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.128 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 491' ' ' PHE . . . . . 0.499 ' HB2' HD12 ' B' ' 501' ' ' LEU . 91.2 t80 -65.44 -44.0 88.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.167 0.508 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.19 -35.52 79.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.653 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 493' ' ' GLN . . . . . 0.431 ' HB3' ' CE1' ' A' ' 164' ' ' HIS . 77.7 mt-30 -83.62 14.6 3.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.644 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 62.22 28.91 17.3 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.643 0.259 . . . . 0.0 111.149 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.425 ' HA ' ' HG3' ' A' ' 160' ' ' ARG . 69.1 t -87.46 -50.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.067 -178.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 46.4 pt -111.26 148.08 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 54.3 p -91.7 -178.66 5.12 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.446 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.711 ' HD3' ' HB2' ' B' ' 525' ' ' TYR . 26.6 ttm180 -55.99 -52.3 64.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.55 -48.35 81.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.352 -177.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.487 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.7 mm-40 -57.21 -46.77 82.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.605 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' B' ' 491' ' ' PHE . 9.6 tt -61.76 -49.29 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.051 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 498' ' ' ARG . 94.7 t -63.15 -30.68 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.878 0.371 . . . . 0.0 111.008 -176.636 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.11 -36.65 55.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.696 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 67.4 mt -65.63 -41.19 92.94 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.876 0.37 . . . . 0.0 111.506 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 7.3 p -84.25 8.84 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.17 0.51 . . . . 0.0 111.206 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.651 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.6 t -57.46 -53.05 69.6 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.054 -179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.651 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 17.1 Cg_exo -69.09 0.2 5.48 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 122.409 2.073 . . . . 0.0 112.93 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.459 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 81.6 m-85 -109.56 -69.35 0.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.822 0.344 . . . . 0.0 110.565 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 516' ' ' PHE . 70.0 mt -86.75 -16.85 35.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.626 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.22 -15.29 65.26 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.277 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -84.18 -11.91 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.182 0.515 . . . . 0.0 110.2 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -123.03 93.71 48.0 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.692 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.51 -54.14 5.95 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.641 2.894 . . . . 0.0 113.555 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.74 -34.91 70.02 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.497 HD12 ' HA ' ' B' ' 515' ' ' LEU . 4.4 tp -80.56 -39.95 26.78 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.001 0.429 . . . . 0.0 110.257 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 2.9 t80 -67.61 -38.65 84.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.852 178.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -65.69 -42.66 90.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.68 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -57.5 -48.05 80.27 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.45 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.2 OUTLIER -58.91 -46.58 87.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.348 -178.872 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.96 -44.74 96.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.393 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -64.31 -40.53 96.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.712 -177.077 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -69.9 -41.97 73.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.507 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.467 HD21 ' CZ ' ' A' ' 200' ' ' PHE . 78.2 mt -77.93 -6.89 55.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.104 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 72.27 32.17 62.92 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.043 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 525' ' ' TYR . . . . . 0.711 ' HB2' ' HD3' ' B' ' 498' ' ' ARG . 64.4 t80 . . . . . 0 C--N 1.321 -0.643 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 16.0 m . . . . . 0 CA--C 1.533 0.303 0 CA-C-O 120.472 0.177 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 24.5 Cg_exo -63.85 152.15 81.99 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.433 2.089 . . . . 0.0 111.112 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -131.38 150.56 52.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.894 0.378 . . . . 0.0 111.399 -175.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.71 144.5 9.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.383 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.78 -47.96 17.72 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 112.104 -173.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt 71.57 -38.64 0.43 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.19 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -65.31 -26.15 67.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.571 0.7 . . . . 0.0 109.195 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -55.93 -24.27 36.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.312 174.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.601 HD11 HD21 ' B' ' 504' ' ' LEU . 75.4 mt -75.47 154.61 36.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.237 0.541 . . . . 0.0 111.275 -176.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -63.66 142.58 58.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.695 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 155' ' ' VAL . . . . . 0.59 ' HB ' ' HD3' ' A' ' 175' ' ' LYS . 5.1 p -58.4 -31.67 43.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.875 0.369 . . . . 0.0 110.577 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.32 -38.98 88.95 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.542 175.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.629 HG21 ' HG2' ' B' ' 500' ' ' GLU . 39.0 m -67.92 -40.07 83.44 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 75.0 mt -63.85 -44.47 93.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.332 0.587 . . . . 0.0 110.006 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -62.59 -33.66 75.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.169 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.643 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 28.4 ttm180 -67.11 -43.67 81.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.078 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 161' ' ' TYR . . . . . 0.519 ' HA ' HG13 ' B' ' 495' ' ' VAL . 69.7 t80 -54.88 -56.31 20.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.838 174.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -67.23 -31.84 72.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.433 -174.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -73.06 -43.42 61.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.705 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 65.9 t-80 -66.91 -41.67 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.546 -178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.98 -4.36 52.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.135 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 56.84 56.65 5.26 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.22 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 88.9 mt -88.57 124.04 66.74 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.339 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.85 127.71 24.36 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.749 2.3 . . . . 0.0 111.548 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.57 ' HB ' HD11 ' A' ' 173' ' ' LEU . 1.3 p . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 121.089 0.471 . . . . 0.0 112.135 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 173' ' ' LEU . . . . . 0.57 HD11 ' HB ' ' A' ' 169' ' ' THR . 99.1 mt . . . . . 0 C--O 1.232 0.161 0 CA-C-O 121.223 0.535 . . . . 0.0 111.855 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.549 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 19.7 t-20 -108.15 159.36 16.66 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.725 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.59 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.8 tptm -49.17 -49.27 43.34 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 122.765 0.426 . . . . 0.0 111.143 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.8 -39.92 91.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.101 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -60.27 -39.58 87.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.125 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.556 ' CD1' HG23 ' A' ' 155' ' ' VAL . 86.3 mt -59.21 -54.68 44.18 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.051 176.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.5 t -56.93 -40.82 74.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 123.833 0.708 . . . . 0.0 111.296 -176.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.7 -50.92 71.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.722 0.296 . . . . 0.0 110.874 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -65.59 -42.88 93.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.588 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 78.9 t -58.38 -49.29 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.35 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.02 94.11 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.575 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -59.42 -45.65 90.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.932 0.396 . . . . 0.0 110.684 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 -83.69 -22.92 31.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.451 . . . . 0.0 110.618 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.588 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.0 t80 -65.47 -41.79 92.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.747 -178.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -71.63 -11.36 60.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.411 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 4.9 p -116.46 22.91 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.916 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 78.2 mt -75.59 125.4 88.63 Favored Pre-proline 0 C--O 1.236 0.359 0 CA-C-O 120.58 0.229 . . . . 0.0 110.456 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 190' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 12.6 Cg_exo -70.18 126.41 13.0 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.992 2.461 . . . . 0.0 110.963 174.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 3.8 p -147.21 155.26 11.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.94 -175.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -136.09 133.03 36.88 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.271 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.63 -64.67 0.74 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -55.91 -53.61 54.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.434 -171.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.99 -43.94 97.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.743 0.306 . . . . 0.0 111.822 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 33.3 m -68.61 -43.14 77.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.237 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.13 -49.91 76.08 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 24.9 m -57.85 -46.69 84.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.864 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.38 -49.64 76.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.772 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.535 ' CD1' HD22 ' B' ' 488' ' ' LEU . 61.2 t80 -61.93 -54.77 37.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.215 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.402 ' HA ' ' HZ ' ' B' ' 522' ' ' PHE . 73.6 mt -58.08 -46.05 88.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.198 0.523 . . . . 0.0 110.872 -177.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.58 -40.27 96.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.152 -176.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 16.5 m -70.67 -54.61 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.124 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 43.8 t -61.47 -35.59 67.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 . . . . . 0 C--N 1.331 -0.238 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 178.758 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.53 0.205 0 CA-C-O 120.48 0.181 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -60.4 3.56 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.79 175.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 39.1 m -65.28 -26.67 68.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.88 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.71 -52.74 59.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.049 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.507 ' O ' HG23 ' B' ' 471' ' ' VAL . 63.7 t80 -54.88 -58.81 6.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.614 176.853 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -65.01 -27.63 68.96 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -172.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -71.36 -42.13 68.86 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.957 0.408 . . . . 0.0 109.992 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -61.51 -45.49 93.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.191 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.528 HG13 HD21 ' B' ' 509' ' ' LEU . 84.8 t -55.95 -47.66 79.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.797 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -59.41 -40.58 87.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.433 -178.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -79.41 -35.02 41.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.728 0.299 . . . . 0.0 111.198 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -70.91 -46.72 62.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 50.7 mt -61.04 -43.55 98.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.494 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 476' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' B' ' 476' ' ' ARG . 25.6 ttt180 70.68 -61.2 0.48 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.154 0.909 . . . . 0.0 112.326 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.8 t -62.87 145.19 55.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.719 -176.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.44 -50.84 63.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.627 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.61 -24.4 64.57 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.359 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.602 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.88 -56.08 15.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.053 0.454 . . . . 0.0 110.186 177.077 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.409 ' CE2' HD11 ' B' ' 485' ' ' LEU . 62.4 t80 -66.74 -37.16 84.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.255 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 34.2 tt0 -63.99 -45.87 87.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.438 179.053 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -60.39 -39.84 88.75 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 67.5 t80 -55.57 -49.91 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.135 174.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.409 HD11 ' CE2' ' B' ' 481' ' ' TYR . 88.6 mt -65.06 -33.97 77.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.188 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.916 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 26.1 mtt180 -64.85 -41.3 95.81 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.893 0.377 . . . . 0.0 110.277 177.123 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 61.4 m -60.87 -34.73 75.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.979 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.535 HD22 ' CD1' ' A' ' 200' ' ' PHE . 44.3 mt -66.99 -52.41 42.98 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.086 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 489' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' B' ' 486' ' ' ARG . 10.8 m -59.6 -42.24 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -177.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.577 ' HA ' ' HG2' ' B' ' 493' ' ' GLN . 17.1 pt -70.47 -32.31 49.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.146 -0.622 . . . . 0.0 111.132 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -64.97 -45.7 84.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.196 0.522 . . . . 0.0 110.176 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -63.94 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.029 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 493' ' ' GLN . . . . . 0.851 ' HG3' HG23 ' B' ' 495' ' ' VAL . 21.3 pt20 -93.68 13.3 22.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.303 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 67.6 35.59 4.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.308 173.505 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.851 HG23 ' HG3' ' B' ' 493' ' ' GLN . 64.8 t -88.8 -52.91 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.029 0.443 . . . . 0.0 110.061 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.422 HG12 HG13 ' B' ' 490' ' ' ILE . 49.5 pt -110.08 145.02 17.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.125 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 497' ' ' SER . . . . . 0.443 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.2 t -84.93 178.49 7.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.981 0.419 . . . . 0.0 110.385 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.59 ' O ' HG23 ' B' ' 502' ' ' VAL . 9.5 ttp180 -55.38 -47.7 75.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.251 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.09 -53.11 62.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.162 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 500' ' ' GLU . . . . . 0.629 ' HG2' HG21 ' A' ' 157' ' ' THR . 1.9 mp0 -56.6 -40.31 75.09 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.795 HD23 HD21 ' B' ' 523' ' ' LEU . 67.8 tp -60.03 -49.39 77.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 110.939 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 498' ' ' ARG . 8.1 t -68.06 -30.32 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.41 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.47 -46.08 70.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.344 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.601 HD21 HD11 ' A' ' 153' ' ' LEU . 86.4 mt -62.37 -40.31 96.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.988 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -87.23 6.78 2.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.084 0.468 . . . . 0.0 111.194 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.654 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 40.3 t -56.19 -52.98 68.59 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.733 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.3 Cg_exo -66.58 -7.94 19.5 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.055 1.837 . . . . 0.0 113.056 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.473 ' O ' ' HD3' ' B' ' 511' ' ' LYS . 96.5 m-85 -100.15 -50.18 4.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.516 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.528 HD21 HG13 ' B' ' 471' ' ' VAL . 86.9 mt -106.6 -8.45 16.96 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.392 -177.241 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.44 -20.17 69.42 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.269 -176.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' B' ' 508' ' ' PHE . 0.0 OUTLIER -83.05 -5.11 58.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.745 0.307 . . . . 0.0 110.652 177.797 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.433 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 58.7 m-85 -118.71 93.23 45.79 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 513' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 9.4 Cg_endo -51.8 -54.23 5.66 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.483 2.788 . . . . 0.0 113.673 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -65.1 -44.57 88.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.303 0.573 . . . . 0.0 110.429 -176.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.64 -42.72 98.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.797 -176.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -72.09 -31.98 66.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.691 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -70.26 -34.69 73.12 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.506 177.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -60.25 -49.22 78.47 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.664 ' O ' HD12 ' B' ' 523' ' ' LEU . 33.1 t80 -54.98 -53.53 54.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.506 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -56.17 -40.94 74.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.784 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -63.46 -35.94 82.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.978 0.418 . . . . 0.0 110.459 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 522' ' ' PHE . . . . . 0.402 ' HZ ' ' HA ' ' A' ' 201' ' ' ILE . 60.7 t80 -65.07 -41.4 95.13 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.653 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.795 HD21 HD23 ' B' ' 501' ' ' LEU . 3.6 mp -76.98 -15.35 59.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.205 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.62 34.06 63.27 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -171.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 69.2 t80 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.013 -0.593 . . . . 0.0 110.494 -174.226 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 146' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 19.3 Cg_exo -63.47 148.1 92.81 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.069 1.846 . . . . 0.0 110.888 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -106.32 158.42 16.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.828 0.347 . . . . 0.0 111.038 -173.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.4 p -110.22 131.79 60.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.412 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -87.92 124.88 34.14 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 88.6 mt -110.17 5.97 22.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -94.01 -15.93 24.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -73.48 -19.5 60.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.397 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' LEU . . . . . 0.46 HD11 HD21 ' B' ' 504' ' ' LEU . 72.5 mt -71.41 156.52 39.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 111.39 -177.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -69.98 158.75 35.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.365 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.51 -41.4 92.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.81 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -64.98 -39.78 93.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.507 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 157' ' ' THR . . . . . 0.432 ' CG2' HG22 ' B' ' 496' ' ' ILE . 25.0 m -57.36 -47.91 80.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.096 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.35 -41.86 96.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.684 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -65.98 -33.52 75.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.623 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 160' ' ' ARG . . . . . 0.472 ' HD3' ' O ' ' B' ' 495' ' ' VAL . 17.9 ttt85 -67.29 -44.4 79.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.212 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -53.47 -49.98 66.3 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.444 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' LYS . . . . . 0.599 ' HE2' HG21 ' A' ' 169' ' ' THR . 9.1 mtpm? -56.9 -42.17 79.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.802 -179.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -72.94 -47.65 43.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.602 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -71.79 -31.58 66.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 165' ' ' PHE . . . . . 0.426 ' CE1' HG22 ' B' ' 490' ' ' ILE . 32.3 m-85 -93.29 1.96 56.78 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.064 178.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 58.2 73.95 0.45 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.448 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.421 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 92.4 mt -114.73 107.66 50.28 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.415 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 168' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 37.5 Cg_endo -67.01 126.2 14.82 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.404 2.069 . . . . 0.0 111.419 178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' THR . . . . . 0.599 HG21 ' HE2' ' A' ' 162' ' ' LYS . 15.0 p . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.266 -175.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 121.135 0.493 . . . . 0.0 111.386 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 174' ' ' ASN . . . . . 0.631 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 59.4 m-80 -136.18 177.05 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.689 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 175' ' ' LYS . . . . . 0.581 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.9 tptm -53.03 -56.07 18.91 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.405 0.44 . . . . 0.0 111.791 -176.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -59.67 -35.5 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.182 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 177' ' ' GLN . . . . . 0.413 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 14.6 mm-40 -66.63 -46.83 74.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.271 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 178' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 69.7 mt -60.04 -48.02 83.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 179' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 175' ' ' LYS . 49.0 t -58.27 -43.33 85.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.943 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -45.94 91.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.581 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 72.5 mt -66.43 -47.64 83.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 CA-C-O 120.994 0.426 . . . . 0.0 110.616 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 182' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 74.1 t -59.87 -49.58 83.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.499 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.53 -40.49 98.78 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.412 -0.423 . . . . 0.0 112.255 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 44.2 t -54.91 -48.55 72.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.807 0.337 . . . . 0.0 110.947 178.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -83.64 -24.95 31.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -177.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 186' ' ' PHE . . . . . 0.508 ' HE1' HD13 ' B' ' 490' ' ' ILE . 39.1 t80 -64.72 -39.43 93.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 122.87 0.468 . . . . 0.0 110.963 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -74.75 5.53 4.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.682 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.4 p -133.43 24.02 4.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.659 0.266 . . . . 0.0 111.477 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 189' ' ' ILE . . . . . 0.587 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.4 mt -86.73 117.69 69.03 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.612 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.66 122.59 9.78 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.808 2.339 . . . . 0.0 111.168 175.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 191' ' ' VAL . . . . . 0.574 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.4 p -134.5 147.36 29.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.906 0.384 . . . . 0.0 110.97 -175.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -118.04 118.47 32.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.142 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 193' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 86.8 tt0 -48.78 -58.78 4.26 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 0.0 112.633 -173.458 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 194' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 194' ' ' LYS . 0.5 OUTLIER -64.68 -49.18 71.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.497 0.189 . . . . 0.0 111.166 -173.368 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.0 -46.51 84.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.792 0.329 . . . . 0.0 111.369 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.5 m -63.03 -41.28 99.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.43 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 197' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 59.1 mt -60.42 -46.37 90.24 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 175.057 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 47.2 m -58.61 -46.68 86.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.732 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 66.1 m -57.05 -54.61 44.84 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.545 177.385 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 200' ' ' PHE . . . . . 0.517 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.7 t80 -56.56 -53.11 61.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.348 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 201' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 197' ' ' LEU . 74.7 mt -55.85 -52.09 52.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.484 -175.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -70.51 -25.94 63.36 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.2 m -72.17 -46.36 56.67 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.706 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 204' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 200' ' ' PHE . 22.0 t -76.2 -35.33 27.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.204 -175.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 205' ' ' ARG . . . . . 0.568 ' HD2' ' OE2' ' B' ' 464' ' ' GLU . 17.9 mtp180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.068 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 120.715 0.293 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 464' ' ' GLU . . . . . 0.568 ' OE2' ' HD2' ' A' ' 205' ' ' ARG . 1.7 mp0 -54.98 -44.45 74.46 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 175.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.0 t -60.5 -40.35 91.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.023 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 466' ' ' LEU . . . . . 0.535 HD21 ' HE3' ' B' ' 470' ' ' LYS . 8.9 tt -62.14 -49.33 76.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.798 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 467' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.5 t80 -54.16 -58.04 8.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.721 176.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 468' ' ' PHE . . . . . 0.4 ' HE1' ' HZ ' ' B' ' 484' ' ' PHE . 46.1 m-85 -64.54 -29.59 70.62 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -174.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.01 -45.04 78.75 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.231 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 470' ' ' LYS . . . . . 0.535 ' HE3' HD21 ' B' ' 466' ' ' LEU . 89.8 mttt -64.31 -40.14 95.32 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.701 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 471' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.1 t -59.79 -42.19 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.499 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.49 -46.36 83.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.921 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -75.67 -34.35 60.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.375 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 474' ' ' ALA . . . . . 0.43 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -69.75 -53.8 16.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.967 -175.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.46 -33.98 76.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.207 -176.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 69.2 -59.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.962 0.789 . . . . 0.0 112.04 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 477' ' ' SER . . . . . 0.401 ' HB3' ' HB3' ' B' ' 480' ' ' ALA . 30.5 t -62.52 126.68 28.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.057 0.456 . . . . 0.0 111.261 -178.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.07 -30.36 70.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.023 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -72.79 -40.71 65.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.924 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 480' ' ' ALA . . . . . 0.486 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.46 -43.41 97.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.468 176.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 481' ' ' TYR . . . . . 0.469 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 47.2 t80 -66.53 -38.53 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.081 178.043 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 482' ' ' GLU . . . . . 0.515 ' HG3' ' CG1' ' A' ' 191' ' ' VAL . 37.8 tt0 -60.62 -40.48 92.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.204 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.43 -42.52 99.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 484' ' ' PHE . . . . . 0.4 ' HZ ' ' HE1' ' B' ' 468' ' ' PHE . 46.6 t80 -55.74 -42.61 75.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.384 172.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 485' ' ' LEU . . . . . 0.574 ' HB3' HG21 ' A' ' 191' ' ' VAL . 92.1 mt -66.99 -32.97 74.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 486' ' ' ARG . . . . . 0.587 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.2 OUTLIER -59.68 -43.24 94.08 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.113 0.482 . . . . 0.0 110.059 172.591 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.4 m -60.84 -35.67 77.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.155 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 488' ' ' LEU . . . . . 0.517 HD22 ' CD1' ' A' ' 200' ' ' PHE . 41.9 mt -68.52 -46.17 70.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.586 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.9 m -65.34 -42.06 92.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.555 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 490' ' ' ILE . . . . . 0.508 HD13 ' HE1' ' A' ' 186' ' ' PHE . 11.3 pt -69.98 -29.64 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.926 178.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -68.23 -42.4 79.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.225 0.536 . . . . 0.0 109.789 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -59.24 -41.29 88.41 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.126 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -89.01 18.02 5.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.169 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 54.28 48.19 21.35 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.765 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 495' ' ' VAL . . . . . 0.472 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 83.2 t -98.21 -42.45 11.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.85 175.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 496' ' ' ILE . . . . . 0.432 HG22 ' CG2' ' A' ' 157' ' ' THR . 41.7 pt -115.82 151.23 17.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.695 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 78.2 p -89.84 177.29 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.624 0.249 . . . . 0.0 110.5 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 498' ' ' ARG . . . . . 0.433 ' O ' HG23 ' B' ' 502' ' ' VAL . 22.9 mtm180 -52.38 -54.17 35.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.449 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.66 -48.48 77.5 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.49 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.13 -39.81 75.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.722 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 501' ' ' LEU . . . . . 0.573 HD23 HD21 ' B' ' 523' ' ' LEU . 53.7 tp -62.95 -47.4 83.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 502' ' ' VAL . . . . . 0.502 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.2 OUTLIER -64.62 -31.3 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.266 0.555 . . . . 0.0 109.923 -179.629 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -67.26 -45.86 75.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.604 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 504' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 153' ' ' LEU . 77.9 mt -64.2 -41.53 97.03 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.783 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 505' ' ' VAL . . . . . 0.412 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.3 p -85.37 3.8 3.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.931 0.396 . . . . 0.0 111.113 -178.145 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 506' ' ' SER . . . . . 0.597 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 22.9 t -55.7 -51.54 79.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.057 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 507' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 50.4 Cg_exo -57.03 -35.04 98.78 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.877 1.718 . . . . 0.0 112.486 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 508' ' ' PHE . . . . . 0.406 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 83.4 m-85 -73.74 -40.86 63.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.27 -174.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 509' ' ' LEU . . . . . 0.412 ' HG ' HG22 ' B' ' 505' ' ' VAL . 81.2 mt -101.95 4.71 40.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.82 0.343 . . . . 0.0 111.242 -176.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.48 -18.41 69.75 Favored Glycine 0 N--CA 1.455 -0.068 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.766 -177.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 511' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' B' ' 511' ' ' LYS . 2.6 mptp? -93.78 -4.71 49.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.076 0.465 . . . . 0.0 109.79 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 512' ' ' PHE . . . . . 0.43 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 43.7 m-85 -129.56 87.28 53.35 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.644 -172.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.55 -43.45 58.84 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.229 2.619 . . . . 0.0 113.18 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.69 -44.4 96.58 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.133 0.492 . . . . 0.0 110.709 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 515' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 515' ' ' LEU . 1.4 tp -69.28 -46.61 66.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.423 -173.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 516' ' ' PHE . . . . . 0.511 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 44.5 t80 -66.78 -36.38 82.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.907 0.384 . . . . 0.0 110.623 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.69 -41.55 75.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.545 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 518' ' ' TRP . . . . . 0.439 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 29.3 t90 -55.14 -48.21 74.02 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 175.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 519' ' ' PHE . . . . . 0.567 ' O ' HD13 ' B' ' 523' ' ' LEU . 19.0 t80 -56.99 -46.96 81.87 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.622 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 520' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 83.1 mttt -56.33 -50.42 71.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.259 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.14 -32.81 74.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.452 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -69.15 -44.12 72.96 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.369 0.604 . . . . 0.0 109.5 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 523' ' ' LEU . . . . . 0.573 HD21 HD23 ' B' ' 501' ' ' LEU . 9.7 mp -73.95 -19.72 60.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.674 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.23 13.99 69.94 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 71.7 t80 . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 121.186 0.517 . . . . 0.0 110.455 -175.367 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.0 p . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 120.425 0.155 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 67.38 177.44 0.24 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.535 177.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 64.27 17.01 10.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.944 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -120.86 -18.16 3.99 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.037 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 29.5 m -145.26 165.44 28.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -103.22 11.85 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.709 0.29 . . . . 0.0 111.451 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -70.79 170.78 11.78 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.043 0.449 . . . . 0.0 110.696 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -87.51 137.02 32.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.531 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -99.83 18.8 55.42 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.918 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 137' ' ' ASP . . . -107.07 -11.03 26.91 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.331 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 136' ' ' GLY . 19.4 t70 72.67 -54.93 0.69 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.4 0.68 . . . . 0.0 111.171 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -145.38 119.34 5.5 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 177.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.35 168.59 15.78 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.53 2.153 . . . . 0.0 111.662 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.53 100.48 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.619 0.723 . . . . 0.0 110.693 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -166.64 106.93 0.65 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.78 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -82.36 -5.53 58.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.421 0.629 . . . . 0.0 110.131 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 19.4 mt -93.42 145.52 7.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.406 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.489 ' O ' ' HB ' ' A' ' 145' ' ' THR . 3.4 m-20 -82.77 15.44 2.66 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.854 0.359 . . . . 0.0 110.895 178.718 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 144' ' ' ASP . 53.5 m 72.02 112.0 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.324 -174.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -59.02 132.79 49.36 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.546 2.164 . . . . 0.0 111.737 -178.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -102.72 138.23 39.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.239 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.68 125.3 40.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.297 0.57 . . . . 0.0 111.277 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 19.5 t0 -81.81 114.38 20.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.589 174.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.73 HD23 HD11 ' B' ' 504' ' ' LEU . 56.3 mt -100.01 -0.45 39.22 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.335 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -82.66 -19.36 38.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.503 -179.267 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' B' ' 504' ' ' LEU . 28.8 pt20 -71.01 -26.8 63.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.847 178.309 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.552 HD21 HD13 ' B' ' 504' ' ' LEU . 86.5 mt -65.25 149.21 50.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.687 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -65.73 152.53 44.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.223 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.472 HG22 ' HD3' ' A' ' 175' ' ' LYS . 57.6 t -55.93 -40.1 60.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.309 0.576 . . . . 0.0 109.796 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.84 -39.04 93.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.527 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.404 HG23 ' HA ' ' B' ' 496' ' ' ILE . 23.0 m -64.21 -44.77 90.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.14 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.07 -41.7 90.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.15 0.5 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.63 -32.39 73.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.418 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.593 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.2 ttm180 -67.47 -44.46 78.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.013 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -51.5 -49.58 61.59 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.063 0.458 . . . . 0.0 110.224 172.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.419 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.4 mtpm? -63.52 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.884 -178.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -79.89 -39.14 31.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.636 0.255 . . . . 0.0 111.328 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -77.87 -32.82 52.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.96 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -91.06 -4.95 55.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.971 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.8 mptt 56.67 81.78 0.13 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.539 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.43 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 90.3 mt -116.8 95.36 46.33 Favored Pre-proline 0 C--N 1.325 -0.466 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 21.0 Cg_endo -61.73 127.27 21.1 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.798 2.332 . . . . 0.0 111.405 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.412 HG21 ' CE ' ' A' ' 162' ' ' LYS . 10.8 p -137.76 177.72 7.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.221 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 171' ' ' PRO . 94.1 mtt180 -93.39 146.2 31.41 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.861 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 24.7 Cg_exo -63.77 146.24 91.74 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.761 2.307 . . . . 0.0 111.908 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.15 7.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.314 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.38 145.08 44.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.948 0.404 . . . . 0.0 111.297 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.58 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 13.9 m120 -121.42 174.96 6.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.258 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.632 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.7 tptm -54.88 -53.1 59.8 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.473 0.483 . . . . 0.0 111.371 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.38 -39.01 85.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.675 0.274 . . . . 0.0 111.196 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -62.12 -46.29 89.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.271 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 84.7 mt -59.05 -49.68 76.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 175' ' ' LYS . 39.0 t -58.73 -40.54 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.344 -176.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -64.72 -49.17 71.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.929 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.32 -47.82 88.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.821 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.24 -47.71 89.4 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.177 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 183' ' ' GLY . . . . . 0.5 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -62.45 -38.96 97.18 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.671 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.46 -41.94 99.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -81.04 -31.6 34.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.651 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.98 -27.87 69.13 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 122.87 0.468 . . . . 0.0 110.922 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 63.5 mttp -72.8 -6.71 46.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.34 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.9 t -133.09 60.74 1.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 110.704 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.974 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 68.8 mt -110.75 119.0 47.37 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.169 175.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.01 129.24 19.12 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.074 2.516 . . . . 0.0 111.214 175.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.0 p -142.45 154.65 18.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.696 -173.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.42 122.01 21.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.638 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 29.0 tt0 -48.79 -64.13 0.89 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.413 0.445 . . . . 0.0 112.146 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -56.86 -53.04 62.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -172.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -66.88 -42.13 86.09 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.712 -176.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.7 m -64.92 -40.79 95.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.978 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 52.5 mt -63.38 -43.9 96.29 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 53.9 m -58.58 -48.99 79.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.097 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 74.7 m -58.36 -48.73 79.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.863 0.364 . . . . 0.0 110.704 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.532 ' CD1' HD22 ' B' ' 488' ' ' LEU . 42.2 t80 -57.33 -55.65 32.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.079 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.544 HD11 ' HE2' ' B' ' 468' ' ' PHE . 85.4 mt -57.64 -45.48 86.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.243 0.544 . . . . 0.0 110.57 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.88 -59.83 4.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.191 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 68.8 m -62.36 -45.4 93.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -174.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.537 HG11 HD23 ' B' ' 523' ' ' LEU . 51.6 t -67.39 -35.32 73.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.37 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -77.46 -13.89 59.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.109 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -103.48 -80.58 0.52 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.979 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.42 107.0 11.95 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.857 0.836 . . . . 0.0 111.097 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -75.46 90.03 2.69 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.434 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 7.5 t30 63.77 85.82 0.13 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.369 -178.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.603 ' HE2' ' HB2' ' A' ' 212' ' ' ASP . 87.2 tttt -81.71 139.3 34.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.701 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 5.8 p -80.03 -73.75 0.34 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 121.197 -0.201 . . . . 0.0 110.73 -179.161 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.603 ' HB2' ' HE2' ' A' ' 210' ' ' LYS . 30.0 t70 47.06 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.516 0.674 . . . . 0.0 112.003 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.88 108.75 14.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.744 -177.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -151.6 135.42 16.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.232 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -91.03 129.26 37.05 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.777 0.322 . . . . 0.0 110.201 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -84.7 -71.48 0.52 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.457 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 8.2 m -83.67 115.89 22.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.803 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -78.8 75.77 1.97 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.939 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 11.2 p -74.85 -29.42 22.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.039 0.447 . . . . 0.0 110.703 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.643 -0.694 . . . . 0.0 109.615 179.875 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 48.0 m . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 120.544 0.212 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 11.9 m120 61.84 27.57 16.82 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.034 175.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -99.03 -75.31 0.56 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.724 0.297 . . . . 0.0 110.97 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 7.7 p -90.71 34.42 0.9 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 111.066 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -101.98 -71.69 0.71 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.184 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -113.72 -36.64 4.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 -176.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -73.32 -72.74 0.95 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.286 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 461' ' ' VAL . . . . . 0.638 HG13 ' HB2' ' B' ' 464' ' ' GLU . 71.0 t -81.35 120.64 33.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.715 0.293 . . . . 0.0 110.344 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -133.1 -67.69 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.342 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 463' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 11.6 t -74.46 -25.39 59.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.13 0.491 . . . . 0.0 110.398 -178.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.638 ' HB2' HG13 ' B' ' 461' ' ' VAL . 2.9 mp0 -66.6 -44.0 83.29 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 176.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 10.7 t -65.24 -33.28 75.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' B' ' 463' ' ' THR . 53.9 tp -60.73 -49.22 78.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.992 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 471' ' ' VAL . 78.1 t80 -55.78 -51.74 66.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.364 176.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.544 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.7 m-85 -65.45 -34.97 79.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.535 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.62 -45.44 94.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -58.85 -48.75 80.26 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.812 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 467' ' ' PHE . 63.3 t -58.92 -47.07 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.875 0.369 . . . . 0.0 110.658 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -39.37 90.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -79.85 -30.77 40.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.196 -175.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.457 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -80.0 -47.69 14.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.611 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 475' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 508' ' ' PHE . 24.9 mt -66.53 -40.39 89.11 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.371 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 71.25 -46.05 0.63 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.525 0.73 . . . . 0.0 112.692 173.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 33.8 t -72.13 136.68 46.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.671 0.272 . . . . 0.0 110.493 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.82 97.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.823 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.55 -29.65 64.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.475 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -68.34 -42.38 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.408 . . . . 0.0 110.425 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -67.48 -37.36 82.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 44.6 tt0 -60.26 -42.1 94.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 174.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.475 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 4.1 t30 -53.59 -49.16 68.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.277 176.187 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -54.07 -47.69 71.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.29 0.567 . . . . 0.0 110.507 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.01 -31.62 72.29 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.134 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.974 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 17.1 mtt85 -67.49 -37.55 83.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.39 . . . . 0.0 110.258 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.4 m -62.17 -36.37 81.67 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.4 mt -66.46 -47.43 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.287 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.538 HG22 ' HA ' ' B' ' 486' ' ' ARG . 12.6 m -64.7 -42.45 95.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.756 -0.377 . . . . 0.0 111.902 -177.371 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.422 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 26.1 pt -69.22 -31.27 49.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.988 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -63.96 -45.74 87.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -64.49 -35.94 82.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -81.92 17.57 1.52 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.693 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 64.22 29.54 13.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 111.064 172.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.593 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 95.8 t -93.33 -55.12 6.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.377 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.404 ' HA ' HG23 ' A' ' 157' ' ' THR . 41.3 pt -104.35 149.49 8.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.802 -0.359 . . . . 0.0 111.194 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.43 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.1 m -78.64 173.77 12.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.512 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -57.78 -58.82 6.7 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.219 0.533 . . . . 0.0 111.076 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 499' ' ' ALA . . . . . 0.661 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -60.81 -38.04 84.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.933 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 7.9 mm-40 -56.4 -38.3 71.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.195 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.9 tp -64.84 -52.46 56.56 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.942 177.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -62.72 -40.66 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.929 -178.773 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -67.48 -37.74 83.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.422 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.73 HD11 HD23 ' A' ' 150' ' ' LEU . 10.7 tp -62.37 -41.78 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.746 0.308 . . . . 0.0 111.181 -174.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 18.0 m -86.11 14.24 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.855 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 48.3 t -57.53 -51.41 81.91 Favored Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 178.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.1 Cg_exo -61.38 -8.42 10.58 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.137 1.891 . . . . 0.0 112.738 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.442 ' HB3' HD21 ' B' ' 475' ' ' LEU . 88.2 m-85 -106.58 -61.5 1.52 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.302 -177.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.49 HD21 HG13 ' B' ' 471' ' ' VAL . 46.4 mt -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.364 -173.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.62 68.43 Favored Glycine 0 N--CA 1.454 -0.118 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.744 -176.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.29 0.567 . . . . 0.0 110.185 178.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.477 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 45.7 m-85 -115.76 98.11 50.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.244 -175.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 513' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.8 Cg_endo -54.17 -46.36 34.16 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.398 2.732 . . . . 0.0 113.211 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -61.81 -38.5 88.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.175 0.512 . . . . 0.0 110.892 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 33.3 tp -74.48 -47.09 35.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.546 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 11.8 t80 -69.36 -32.22 71.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.738 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -70.14 -40.32 74.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.226 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -54.84 -48.36 72.98 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.609 ' O ' ' HG ' ' B' ' 523' ' ' LEU . 8.4 t80 -56.79 -49.71 74.53 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.652 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.604 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 94.8 mttt -59.01 -44.74 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.529 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -64.14 -35.24 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.812 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -71.79 -38.9 70.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.569 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' B' ' 519' ' ' PHE . 68.0 mt -77.1 -13.45 59.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.221 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 70.36 43.46 62.3 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -173.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -81.61 98.22 8.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.987 0.422 . . . . 0.0 109.998 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -67.73 -76.19 0.09 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.323 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 58.76 19.08 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.533 -177.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 C--O 1.247 0.964 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.71 -176.859 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 65.66 -176.77 0.18 Allowed 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.023 0.529 . . . . 0.0 111.177 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -157.14 -169.26 2.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.07 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -88.68 -148.36 16.94 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.176 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.6 p -95.06 -3.65 47.81 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.364 0.602 . . . . 0.0 109.902 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -122.34 131.13 53.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.415 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -107.75 103.94 13.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.109 0.481 . . . . 0.0 110.564 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -107.57 112.17 24.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.062 178.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -165.69 101.86 0.19 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.104 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -156.12 80.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -69.58 -40.63 76.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.749 0.309 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 9.3 t -149.86 106.46 3.23 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.68 125.01 11.69 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.677 2.251 . . . . 0.0 112.168 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 33.2 m -74.77 155.79 6.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.781 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -101.63 77.23 1.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.337 0.589 . . . . 0.0 109.746 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -83.93 -28.52 27.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.895 -177.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.445 HG22 ' O ' ' A' ' 143' ' ' ILE . 36.1 mt 72.81 11.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.443 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.586 ' O ' ' HB ' ' A' ' 145' ' ' THR . 28.5 t70 59.93 10.07 2.0 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.734 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 145' ' ' THR . . . . . 0.586 ' HB ' ' O ' ' A' ' 144' ' ' ASP . 25.0 m 73.45 110.5 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.434 -172.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' B' ' 508' ' ' PHE . 32.4 Cg_exo -57.07 136.29 75.76 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 111.392 174.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -110.06 166.07 11.23 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.667 -176.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.532 HG12 ' ND2' ' B' ' 483' ' ' ASN . 6.8 p -114.01 140.48 34.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.861 176.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 12.5 t70 -106.33 124.52 49.72 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.433 HD13 HG12 ' A' ' 182' ' ' VAL . 61.7 mt -104.05 2.53 32.25 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.393 0.616 . . . . 0.0 110.624 -177.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -86.39 -21.92 26.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.758 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.45 HE21 ' HB3' ' B' ' 503' ' ' GLN . 19.0 pt20 -73.34 -17.57 61.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.835 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.466 HD11 HD21 ' B' ' 504' ' ' LEU . 76.2 mt -75.1 173.1 11.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.269 0.557 . . . . 0.0 111.621 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.7 mp0 -87.6 144.8 26.5 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.33 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 178' ' ' LEU . 55.3 t -54.08 -42.26 54.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.516 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.69 -35.41 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.145 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.6 m -69.83 -42.02 74.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.767 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 162' ' ' LYS . 74.7 mt -64.56 -40.94 96.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.226 178.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 159' ' ' ARG . 27.9 mtp85 -64.71 -37.42 87.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.594 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 160' ' ' ARG . 35.2 ttm105 -66.25 -38.85 88.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.446 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.487 ' HA ' HG13 ' B' ' 495' ' ' VAL . 60.4 t80 -56.44 -51.52 68.08 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.275 172.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.635 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 7.4 mtpm? -60.97 -35.19 76.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.457 -177.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -76.43 -34.91 58.76 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.929 -176.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -77.16 -42.4 37.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.338 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.43 ' CE1' HG22 ' B' ' 490' ' ' ILE . 58.2 m-85 -89.63 3.01 53.96 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.465 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 54.5 74.57 0.34 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.7 0.625 . . . . 0.0 111.307 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 84.8 mt -111.05 144.56 30.64 Favored Pre-proline 0 C--N 1.328 -0.353 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.093 -177.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.47 162.58 33.26 Favored 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.041 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.5 p -140.88 179.01 6.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.949 0.404 . . . . 0.0 111.286 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -144.84 145.69 28.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -57.52 128.25 28.61 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.667 2.244 . . . . 0.0 112.177 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 99.24 39.38 3.51 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.136 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 75.2 mt -65.76 155.4 36.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.122 0.486 . . . . 0.0 111.337 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.47 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 8.2 t-20 -154.63 -171.67 3.93 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.4 tptm -64.09 -62.1 1.84 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.731 0.241 . . . . 0.0 111.251 -176.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.21 -30.13 64.3 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.701 0.286 . . . . 0.0 111.383 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 8.9 mm-40 -59.02 -55.29 37.1 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.67 0.748 . . . . 0.0 110.393 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.549 ' CD1' HG13 ' A' ' 155' ' ' VAL . 53.4 mt -64.29 -41.56 96.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.661 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.6 t -60.48 -37.92 76.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.773 -178.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.99 -53.26 48.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.874 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.426 HG21 ' HE2' ' A' ' 162' ' ' LYS . 55.3 mt -60.32 -49.33 84.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 121.01 0.433 . . . . 0.0 110.744 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.433 HG12 HD13 ' A' ' 150' ' ' LEU . 77.5 t -59.17 -49.09 84.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.939 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.58 -37.32 94.0 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.439 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 29.1 t -61.97 -42.36 99.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.93 0.395 . . . . 0.0 110.907 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 -87.26 -25.11 24.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.387 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.413 ' CE2' HG11 ' A' ' 148' ' ' VAL . 73.9 t80 -62.22 -43.58 98.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.104 0.478 . . . . 0.0 110.651 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -80.94 8.13 9.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.566 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 3.2 p -125.12 14.18 8.4 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.805 0.336 . . . . 0.0 111.274 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.442 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 75.6 mt -79.58 120.75 81.24 Favored Pre-proline 0 C--O 1.235 0.321 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.55 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.99 115.96 4.49 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.994 2.463 . . . . 0.0 111.294 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.475 HG21 ' HB3' ' B' ' 485' ' ' LEU . 3.8 p -127.89 156.21 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.068 -174.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 18.9 m120 -128.97 138.33 51.89 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.729 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 27.1 tt0 -55.54 -67.28 0.3 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -72.7 -36.47 67.84 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.777 0.322 . . . . 0.0 110.965 -172.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 195' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 12.1 t70 -55.25 -49.6 71.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.993 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 90.4 m -75.54 -35.35 60.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.501 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 35.7 mt -58.45 -46.62 86.17 Favored 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.9 m -61.49 -43.53 98.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.0 m -58.08 -50.99 71.54 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.875 0.369 . . . . 0.0 111.013 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.2 t80 -65.1 -47.13 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.574 -175.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 197' ' ' LEU . 77.5 mt -61.95 -45.71 98.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.034 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -66.42 -35.96 81.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.496 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.9 m -62.41 -61.33 2.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.63 HG13 ' HG2' ' A' ' 208' ' ' LYS . 99.4 t -61.91 -39.71 84.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.855 -174.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -73.59 -9.7 58.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.742 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -109.23 -72.15 0.73 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.878 0.37 . . . . 0.0 110.214 177.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -144.55 116.46 8.29 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 174.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.63 ' HG2' HG13 ' A' ' 204' ' ' VAL . 85.4 mttt -70.81 -56.51 6.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.884 -168.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 4.5 t30 179.67 117.52 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.42 145.31 18.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.252 0.548 . . . . 0.0 111.523 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 211' ' ' SER . . . . . 0.626 ' HB3' ' HB3' ' A' ' 214' ' ' LYS . 15.7 m -137.52 112.14 8.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.213 -175.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -106.98 120.92 43.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 34.1 tp 61.59 64.12 1.09 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.625 0.726 . . . . 0.0 109.438 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 214' ' ' LYS . . . . . 0.858 ' H ' ' HD3' ' A' ' 214' ' ' LYS . 0.0 OUTLIER -98.27 -50.09 4.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.214 -171.592 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 215' ' ' ALA . . . . . 0.423 ' N ' ' HG2' ' A' ' 214' ' ' LYS . . . -173.36 -50.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.507 0.194 . . . . 0.0 111.071 -174.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 67.38 27.26 8.2 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.224 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.5 m -129.19 151.5 49.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.452 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 101.62 -140.11 14.72 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.5 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 26.8 m -111.84 -7.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.986 0.422 . . . . 0.0 110.851 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.021 -179.27 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.83 0.348 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -82.14 -40.38 21.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.085 0.469 . . . . 0.0 110.049 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.65 167.18 13.6 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.743 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 39.9 t -114.39 140.9 48.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.7 0.286 . . . . 0.0 110.436 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -75.42 -42.89 52.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.3 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -85.6 -29.31 24.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.811 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 89.65 -50.32 3.49 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.863 176.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 27.3 m -117.75 161.29 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.844 0.354 . . . . 0.0 111.137 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -157.51 50.84 0.42 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.655 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.5 t -70.37 -23.35 62.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.492 0.187 . . . . 0.0 111.329 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -63.59 -53.63 48.59 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -60.67 -33.45 72.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.606 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.32 -50.7 71.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.247 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.464 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.5 t80 -52.62 -51.31 60.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.774 175.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.414 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 60.4 m-85 -65.02 -34.61 78.83 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.53 -38.16 88.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.935 0.398 . . . . 0.0 110.134 176.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -63.95 -47.06 81.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.223 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.489 HG13 HD21 ' B' ' 509' ' ' LEU . 75.2 t -58.74 -45.24 91.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 110.465 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -59.33 -38.06 79.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -79.01 -41.38 29.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.183 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.536 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -67.27 -43.41 81.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.184 -174.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.02 -30.65 69.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.095 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 69.23 -59.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.526 0 O-C-N 123.942 0.776 . . . . 0.0 112.104 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 32.8 t -69.06 135.09 50.26 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.238 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.17 81.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.245 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.27 -39.24 82.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.259 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.419 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.31 -45.85 89.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.104 0.478 . . . . 0.0 110.326 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.43 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 55.3 t80 -66.81 -31.5 72.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.113 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.663 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 33.5 tt0 -65.49 -42.94 91.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.668 176.336 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.532 ' ND2' HG12 ' A' ' 148' ' ' VAL . 5.5 m-20 -55.67 -46.28 77.58 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.817 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -55.94 -46.79 78.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.475 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.5 mt -67.73 -32.69 73.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -61.3 -41.33 96.8 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 120.815 0.341 . . . . 0.0 110.183 173.381 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.6 m -62.48 -35.49 79.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.224 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.453 HD22 ' CG ' ' A' ' 200' ' ' PHE . 40.2 mt -68.51 -47.19 67.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.435 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.4 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.5 m -65.33 -40.81 89.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.665 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.8 pt -69.44 -32.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.735 178.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -65.18 -42.79 93.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.21 0.529 . . . . 0.0 109.727 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.19 -38.23 82.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.87 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -86.79 15.95 5.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.475 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 60.5 26.34 15.98 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.752 0.421 . . . . 0.0 111.631 177.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 161' ' ' TYR . 53.6 t -77.13 -48.48 24.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.571 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 38.4 pt -113.3 155.58 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.997 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.453 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 81.4 p -96.27 -173.32 2.76 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -54.88 -59.54 4.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.0 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 499' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -58.6 -40.51 83.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.962 -173.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.571 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 6.7 mm-40 -59.19 -44.0 92.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.425 0.631 . . . . 0.0 109.908 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.515 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -62.3 -46.07 90.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.226 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -67.2 -32.9 59.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.728 -178.139 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.45 ' HB3' HE21 ' A' ' 152' ' ' GLN . 87.2 mt-30 -71.57 -39.9 70.29 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.466 HD21 HD11 ' A' ' 153' ' ' LEU . 74.9 mt -65.05 -38.73 91.76 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.885 0.374 . . . . 0.0 111.891 -177.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 34.9 m -84.92 11.41 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.583 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.642 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 43.8 t -61.03 -52.21 73.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.865 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 32.2 Cg_exo -63.61 -15.93 51.62 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.898 1.732 . . . . 0.0 112.378 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.442 ' CD2' ' HB2' ' A' ' 146' ' ' PRO . 94.9 m-85 -90.56 -65.73 0.99 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.082 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.489 HD21 HG13 ' B' ' 471' ' ' VAL . 87.9 mt -92.33 -5.13 52.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.438 -173.144 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.64 -17.1 68.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.431 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -72.57 -21.1 61.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 176.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.536 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 22.6 m-85 -123.28 86.47 51.71 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.682 -176.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.7 -46.49 29.73 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 123.155 2.57 . . . . 0.0 113.185 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -65.07 -37.55 87.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.871 0.367 . . . . 0.0 111.249 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 20.7 tp -70.4 -38.73 74.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.296 0.57 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.601 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 54.0 t80 -65.38 -35.39 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.828 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -70.01 -32.86 71.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.057 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -59.14 -48.85 80.07 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -56.28 -46.7 79.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.522 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.601 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 92.6 mttt -60.64 -41.01 94.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.186 176.057 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -61.58 -30.56 70.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -75.92 -39.32 56.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.286 0.565 . . . . 0.0 109.928 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.515 HD21 HD23 ' B' ' 501' ' ' LEU . 10.2 mp -80.76 -24.64 38.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.074 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 95.03 30.55 8.24 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.787 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 525' ' ' TYR . . . . . 0.463 ' HD1' ' H ' ' B' ' 527' ' ' GLU . 0.2 OUTLIER -86.4 92.95 8.99 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.143 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 526' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' B' ' 526' ' ' LYS . 1.8 tppp? -95.65 28.04 3.19 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.403 -176.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 527' ' ' GLU . . . . . 0.463 ' H ' ' HD1' ' B' ' 525' ' ' TYR . 15.6 mm-40 60.82 25.68 15.56 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.308 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 51.5 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.145 179.719 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 p . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 120.472 0.177 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 63.0 25.84 15.23 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -86.3 108.02 18.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.373 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 171.77 179.6 42.87 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.789 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 34.8 t -144.74 163.74 33.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.866 0.365 . . . . 0.0 110.533 -177.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -100.26 -1.67 35.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.906 176.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 42.27 -101.42 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.06 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.5 t70 54.29 79.06 0.14 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.445 0.64 . . . . 0.0 110.603 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.88 -74.49 0.46 Allowed Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.455 -176.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 95.34 46.24 2.83 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.697 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -72.47 108.73 5.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.938 0.399 . . . . 0.0 110.447 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.536 ' HB2' ' HB3' ' A' ' 141' ' ' GLN . 14.8 m -83.97 131.15 52.31 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.098 -178.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.68 -55.43 3.55 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.746 2.297 . . . . 0.0 111.868 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.968 ' HB ' ' HG2' ' B' ' 511' ' ' LYS . 39.0 t -116.53 103.33 14.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.536 ' HB3' ' HB2' ' A' ' 138' ' ' SER . 26.8 pt20 -128.52 -179.57 5.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.326 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 24.0 t70 64.91 101.92 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.872 0.733 . . . . 0.0 110.987 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.498 ' O ' ' HD3' ' B' ' 476' ' ' ARG . 0.7 OUTLIER -148.38 137.38 15.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.217 -177.489 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.8 t70 -111.45 -47.77 3.15 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 34.1 m -151.73 96.02 3.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.916 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.05 155.12 57.48 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.187 1.925 . . . . 0.0 111.737 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.29 137.04 51.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.131 0.491 . . . . 0.0 111.714 -172.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.46 133.59 28.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.086 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -87.38 -26.81 23.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.215 0.531 . . . . 0.0 111.109 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 74.6 mt 64.15 13.77 8.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.227 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.14 -16.03 34.53 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.05 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.8 -15.08 60.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.328 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 157' ' ' THR . 81.2 mt -67.44 140.4 57.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.53 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.19 157.83 36.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.797 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 88.7 t -56.16 -44.17 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.855 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -64.31 -36.58 84.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.808 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.415 HG21 HD22 ' A' ' 153' ' ' LEU . 10.4 m -63.58 -46.58 85.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.629 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.462 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 68.5 mt -62.48 -42.73 99.69 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.743 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 66.4 mtp85 -70.08 -28.81 65.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.503 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 33.7 ttm180 -72.34 -44.6 62.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.513 ' HA ' HG13 ' B' ' 495' ' ' VAL . 57.7 t80 -51.98 -51.22 58.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.081 172.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.695 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 19.8 mtpp -65.97 -29.73 70.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.279 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -81.84 -42.67 19.29 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.701 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 -68.39 -32.77 73.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.874 -175.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -95.7 0.11 52.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.151 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 57.64 77.53 0.27 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.016 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 77.0 mt -120.67 134.85 24.31 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.78 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.75 155.15 65.23 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.908 2.405 . . . . 0.0 113.114 -173.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.639 ' HB ' HD11 ' A' ' 173' ' ' LEU . 67.8 p -138.56 -179.56 5.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.358 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.5 ppt_? -165.18 159.26 14.35 Favored Pre-proline 0 C--N 1.327 -0.41 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 177.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.38 131.5 45.63 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.75 2.3 . . . . 0.0 112.557 179.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 108.05 31.67 3.52 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.639 HD11 ' HB ' ' A' ' 169' ' ' THR . 79.6 mt -80.92 140.15 35.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.217 0.532 . . . . 0.0 111.008 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.584 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 93.2 m-20 -131.11 172.95 11.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.184 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.594 ' O ' HG23 ' A' ' 179' ' ' VAL . 21.5 tptm -56.39 -53.9 51.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.353 0.408 . . . . 0.0 110.339 176.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 176' ' ' ALA . . . . . 0.597 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -62.05 -34.21 75.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.423 -178.715 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.584 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.6 mm100 -67.03 -41.74 86.06 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.032 0.444 . . . . 0.0 110.879 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 88.0 mt -61.22 -47.87 84.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.837 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 175' ' ' LYS . 35.6 t -60.19 -32.61 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.801 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 13.2 mm-40 -61.97 -57.45 11.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 110.691 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.695 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 38.6 mt -61.69 -43.2 96.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.676 -178.147 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 178' ' ' LEU . 71.8 t -59.64 -49.0 85.35 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.316 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.2 -40.86 99.54 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.314 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 41.2 t -55.85 -42.73 76.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 111.195 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -86.38 -30.49 22.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.873 0.368 . . . . 0.0 111.3 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -63.87 -32.01 73.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.145 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.63 14.64 1.59 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.54 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 43.0 m -147.45 34.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.692 0.282 . . . . 0.0 111.457 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.908 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 72.4 mt -93.31 114.92 64.16 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.752 -0.203 . . . . 0.0 110.613 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.29 127.24 18.69 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.67 2.247 . . . . 0.0 110.892 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 9.0 p -144.61 149.76 16.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.739 -174.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.694 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 12.6 m-80 -112.52 155.42 24.34 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.1 tt0 -71.64 -66.68 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -178.042 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -73.49 -43.79 59.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.253 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 195' ' ' ASP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 15.0 t70 -52.64 -48.4 66.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.998 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 36.7 m -71.3 -42.76 68.25 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.338 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 55.0 mt -56.8 -45.94 81.91 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.147 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 18.2 m -62.19 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.906 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 79.4 m -59.8 -49.86 76.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.865 0.364 . . . . 0.0 110.918 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.541 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.6 t80 -60.86 -55.31 34.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.826 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.505 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 76.0 mt -54.35 -50.41 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.669 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -58.34 -43.34 88.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.782 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 -43.82 92.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.488 -179.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 200' ' ' PHE . 17.8 t -73.5 -22.29 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-O 121.34 0.591 . . . . 0.0 110.562 -178.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 9.9 mmm180 -69.4 -32.05 70.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.138 172.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -84.98 -54.07 4.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.908 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.513 ' OD1' ' HA ' ' A' ' 211' ' ' SER . 11.4 t70 -141.8 -162.01 1.32 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.435 ' H ' ' CG ' ' A' ' 207' ' ' ASP . 32.8 mmtp -112.68 -16.64 12.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -154.42 -49.52 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.579 176.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -175.52 124.56 0.23 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.657 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 211' ' ' SER . . . . . 0.513 ' HA ' ' OD1' ' A' ' 207' ' ' ASP . 73.2 m -57.09 104.23 0.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.521 0.676 . . . . 0.0 112.037 -173.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -102.88 -70.57 0.75 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.777 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 213' ' ' LEU . . . . . 0.486 ' HB3' ' HD3' ' A' ' 214' ' ' LYS . 51.4 tp 179.43 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.128 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 214' ' ' LYS . . . . . 0.486 ' HD3' ' HB3' ' A' ' 213' ' ' LEU . 0.0 OUTLIER -131.36 51.54 2.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.809 -178.343 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -79.19 -18.38 53.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.689 0.757 . . . . 0.0 110.086 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.1 -52.25 7.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.368 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 47.5 t -170.58 -60.83 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.814 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 72.39 -79.39 0.66 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.503 -176.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 15.0 p -124.18 -20.53 3.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.98 0.419 . . . . 0.0 110.22 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.425 -0.798 . . . . 0.0 110.25 -177.805 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 120.93 0.395 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -100.18 119.04 37.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.129 175.277 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -81.98 166.65 19.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.392 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 34.9 t -84.3 10.13 11.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.311 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 60.8 mttm 61.6 -153.27 0.36 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.24 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -128.86 132.56 47.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.875 0.369 . . . . 0.0 110.792 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 135.44 104.69 0.78 Allowed Glycine 0 N--CA 1.445 -0.735 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.632 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 32.7 m -80.65 -25.51 11.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.804 0.335 . . . . 0.0 110.864 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 134.12 -167.77 23.61 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.03 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.2 p -64.97 -15.71 62.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.989 0.423 . . . . 0.0 111.64 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.582 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.4 mp0 -57.17 -36.01 70.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.73 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 31.8 t -61.17 -43.04 99.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.224 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.412 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.4 tt -62.75 -46.01 90.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.728 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.573 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.5 t80 -52.88 -59.53 4.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.543 177.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.458 ' HE2' HD11 ' A' ' 201' ' ' ILE . 51.3 m-85 -65.18 -36.21 83.49 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -174.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.47 -45.18 94.21 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 470' ' ' LYS . . . . . 0.434 ' HD2' HD13 ' B' ' 515' ' ' LEU . 23.6 ttmm -67.8 -40.85 83.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.637 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.573 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.2 t -56.21 -48.6 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.903 0.383 . . . . 0.0 110.462 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 472' ' ' ARG . . . . . 0.408 ' O ' ' HD3' ' B' ' 472' ' ' ARG . 1.5 tmt_? -57.07 -45.21 83.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.381 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -76.94 -37.04 56.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.666 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -69.61 -41.08 76.19 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -176.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.13 -32.56 73.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.422 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.498 ' HD3' ' O ' ' A' ' 143' ' ' ILE . 40.2 ttt180 69.28 -1.63 2.11 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.875 0.735 . . . . 0.0 111.875 173.169 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 21.4 t -127.14 131.31 50.79 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.23 -35.66 80.04 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.106 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.01 -37.87 81.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.342 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.24 -37.5 78.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.859 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -68.87 -37.69 79.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.003 0.43 . . . . 0.0 109.907 177.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.9 tt0 -61.37 -42.44 98.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.474 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 1.7 t-20 -52.21 -51.41 58.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.036 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 87.8 t80 -52.71 -47.62 67.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.682 177.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.03 -33.31 75.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.203 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.908 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.8 mtt180 -66.37 -37.74 85.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 176.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 84.1 m -61.18 -36.3 79.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.864 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.541 HD22 ' CG ' ' A' ' 200' ' ' PHE . 62.0 mt -68.89 -45.84 69.93 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.566 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -64.62 -42.31 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.478 -178.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.437 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 17.6 pt -69.18 -32.02 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.608 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.85 -44.3 90.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.079 0.466 . . . . 0.0 109.987 172.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -68.85 -16.68 63.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.831 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -101.37 16.49 25.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.27 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 65.56 10.84 6.99 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.425 0.453 . . . . 0.0 111.647 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.9 t -70.55 -47.22 66.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.915 0.388 . . . . 0.0 110.807 -176.703 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.6 pt -112.07 179.71 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.182 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.0 m -119.8 170.95 8.77 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.057 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.5 ' O ' HG23 ' B' ' 502' ' ' VAL . 55.6 ttp180 -50.57 -56.52 11.37 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.519 0.512 . . . . 0.0 111.384 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.34 -43.65 83.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.336 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 12.4 mm-40 -56.01 -49.0 74.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.362 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.459 ' C ' HD23 ' B' ' 501' ' ' LEU . 8.9 tt -61.64 -46.27 90.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.765 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 498' ' ' ARG . 90.2 t -59.76 -36.69 67.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -82.32 -27.12 32.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.468 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 20.7 mt -65.0 -43.19 93.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.004 0.43 . . . . 0.0 111.528 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.47 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.4 p -84.63 11.51 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.108 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.456 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 32.9 t -59.73 -50.07 88.61 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.158 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.467 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 11.5 Cg_endo -60.56 -8.2 8.56 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.255 1.97 . . . . 0.0 113.308 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.467 ' CE2' ' HG2' ' B' ' 507' ' ' PRO . 65.9 m-85 -110.45 -61.38 1.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.249 -175.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.572 HD22 HD23 ' B' ' 515' ' ' LEU . 74.7 mt -96.93 -14.79 21.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.807 -0.179 . . . . 0.0 111.474 -174.54 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.8 -19.04 64.9 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.668 -176.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.968 ' HG2' ' HB ' ' A' ' 140' ' ' VAL . 8.0 mtpt -85.73 -3.81 59.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.694 0.283 . . . . 0.0 110.812 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.456 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 74.0 m-85 -122.98 95.11 46.57 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.69 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 513' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 8.2 Cg_endo -51.24 -50.75 12.92 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.21 2.606 . . . . 0.0 113.1 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.73 -39.17 87.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.9 0.381 . . . . 0.0 111.577 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.572 HD23 HD22 ' B' ' 509' ' ' LEU . 14.6 tp -78.13 -41.38 35.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 -173.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -66.96 -39.25 87.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.681 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.84 -36.19 83.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.582 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 8.7 t90 -59.4 -49.03 79.37 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.44 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.3 OUTLIER -62.48 -42.66 99.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.627 -177.186 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -61.96 -40.15 94.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.793 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -63.42 -47.61 81.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.049 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.91 -35.18 79.92 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.01 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.52 -9.23 58.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.657 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.08 41.18 61.04 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.203 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 525' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' B' ' 527' ' ' GLU . 65.8 t80 -80.53 105.86 12.1 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -59.82 -71.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.715 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 527' ' ' GLU . . . . . 0.506 ' HB2' ' CE2' ' B' ' 525' ' ' TYR . 43.4 tt0 64.58 92.03 0.07 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.149 -177.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.459 179.239 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 69.02 83.96 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 O-C-N 123.74 0.65 . . . . 0.0 110.35 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -104.94 -22.75 13.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.435 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 172.27 102.66 0.16 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.839 -0.696 . . . . 0.0 111.738 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.2 m -75.58 -50.47 15.47 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.16 90.49 0.03 OUTLIER 'General case' 0 C--O 1.235 0.34 0 O-C-N 124.157 0.911 . . . . 0.0 111.985 177.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.08 -37.61 86.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.542 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -169.35 115.47 0.58 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.285 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -171.98 49.54 0.18 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.032 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -177.47 79.25 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.075 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -99.22 141.11 32.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.02 0.438 . . . . 0.0 110.537 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 24.4 m -96.63 119.87 63.08 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.445 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 5.5 Cg_exo -77.86 -159.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 123.16 2.573 . . . . 0.0 112.006 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.9 m -82.2 17.79 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.028 0.442 . . . . 0.0 111.168 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -170.24 -170.12 0.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.8 t70 65.67 86.59 0.13 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.395 0.616 . . . . 0.0 110.093 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.55 HG21 ' HG3' ' A' ' 146' ' ' PRO . 1.4 mp -77.59 143.19 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.424 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.507 ' O ' ' HB2' ' B' ' 477' ' ' SER . 10.2 t70 -90.94 -60.45 1.91 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 37.7 m -157.31 110.36 1.87 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.094 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.55 ' HG3' HG21 ' A' ' 143' ' ' ILE . 2.6 Cg_exo -75.61 163.37 34.1 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.543 2.162 . . . . 0.0 111.829 176.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -114.78 154.23 28.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.472 -178.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.7 p -112.17 135.61 50.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.365 178.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -101.15 133.65 45.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.155 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.429 ' HB2' HG13 ' A' ' 179' ' ' VAL . 64.7 mt -114.82 3.31 14.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.65 0.738 . . . . 0.0 110.117 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -28.76 40.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.43 -0.804 . . . . 0.0 108.956 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.431 ' HG3' ' N ' ' A' ' 153' ' ' LEU . 3.7 pt20 -59.13 -32.05 69.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.475 175.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.566 HD11 HD21 ' B' ' 504' ' ' LEU . 69.3 mt -69.23 166.83 17.57 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.399 0.619 . . . . 0.0 112.186 -172.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -73.57 163.95 27.32 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.406 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.43 -44.8 76.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.278 0.561 . . . . 0.0 109.842 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -64.83 -31.3 72.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.165 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.4 m -60.55 -45.73 92.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.17 0.51 . . . . 0.0 110.797 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 182' ' ' VAL . 87.4 mt -68.91 -38.56 79.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.791 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -63.05 -40.39 97.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.512 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -64.08 -41.58 97.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.272 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -54.02 -52.29 61.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.762 173.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.637 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 22.5 mtpp -67.19 -28.13 67.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.207 -175.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -78.22 -42.57 30.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.681 0.277 . . . . 0.0 111.148 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -77.43 -36.78 52.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.687 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.499 ' CE1' HG22 ' B' ' 490' ' ' ILE . 43.7 m-85 -83.72 -4.21 58.42 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.337 178.257 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 59.03 78.77 0.25 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.625 0.578 . . . . 0.0 111.174 178.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.607 HD12 ' HG2' ' A' ' 162' ' ' LYS . 92.5 mt -115.71 113.19 42.58 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.06 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 15.9 Cg_exo -68.07 135.92 36.27 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.647 2.898 . . . . 0.0 112.057 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.422 ' CG2' HD11 ' A' ' 173' ' ' LEU . 3.7 t -171.04 159.73 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.652 -177.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -67.79 156.63 88.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.543 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.32 154.59 32.15 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.723 2.282 . . . . 0.0 112.407 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 85.36 50.4 4.06 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.258 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.422 HD11 ' CG2' ' A' ' 169' ' ' THR . 86.5 mt -94.03 145.38 24.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.854 0.359 . . . . 0.0 110.56 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.443 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 88.4 m-20 -113.59 178.03 4.42 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.256 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.696 ' O ' HG23 ' A' ' 179' ' ' VAL . 55.4 tptt -46.05 -57.91 4.05 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.879 0.737 . . . . 0.0 112.166 -177.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 176' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -54.52 -49.63 69.76 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -176.069 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.1 -43.02 91.84 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.017 0.437 . . . . 0.0 110.594 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 94.8 mt -61.81 -48.85 78.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.022 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 175' ' ' LYS . 13.6 t -58.66 -42.6 85.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.501 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 19.3 mm-40 -58.28 -49.74 76.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.651 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.637 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 79.6 mt -65.4 -48.48 82.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.068 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.1 t -59.28 -45.76 92.88 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.959 -177.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.16 -39.91 94.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.374 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.4 t -59.22 -40.49 86.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.755 0.312 . . . . 0.0 110.726 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -87.25 -26.43 23.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.776 0.322 . . . . 0.0 111.089 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.58 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 27.4 t80 -60.9 -44.02 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.008 0.523 . . . . 0.0 111.136 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -79.94 21.64 0.55 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.06 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 45.5 m -145.77 28.75 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.816 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.642 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 73.2 mt -90.1 125.38 60.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.666 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.47 140.3 51.97 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.837 2.358 . . . . 0.0 110.973 172.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.614 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.0 p -153.05 134.74 5.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.16 0.505 . . . . 0.0 110.925 -174.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -102.78 109.17 20.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.599 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 40.1 tt0 -47.89 -62.56 1.4 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -169.05 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -65.37 -45.13 85.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.504 0.192 . . . . 0.0 111.494 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.68 -43.26 99.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.601 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 89.7 m -65.2 -37.16 86.44 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.039 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 22.1 mt -60.99 -47.27 87.23 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.4 m -59.17 -46.06 89.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.354 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 69.3 m -61.15 -51.22 69.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.346 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.599 ' CD1' HD22 ' B' ' 488' ' ' LEU . 45.8 t80 -56.24 -55.99 26.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.291 -178.14 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.599 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 74.9 mt -55.72 -48.86 77.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.21 -42.07 98.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.845 -177.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.4 m -62.95 -42.77 99.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.414 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 200' ' ' PHE . 56.6 t -68.84 -28.09 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.04 0.448 . . . . 0.0 110.736 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.599 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 14.2 mmm-85 -72.92 -18.05 61.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.538 175.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -92.89 -45.22 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -164.27 168.77 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 498' ' ' ARG . 13.3 mptt -91.42 -10.49 40.83 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.724 178.508 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -163.26 151.51 13.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.431 ' HA ' ' HG3' ' B' ' 494' ' ' GLU . 54.3 mtpt 51.43 46.17 26.9 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.501 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 15.6 m -52.09 109.23 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.583 0.552 . . . . 0.0 110.957 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -75.05 130.55 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.389 -175.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 32.1 tp -150.47 -43.03 0.13 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.194 -177.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -170.48 170.22 7.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.027 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -85.43 -65.12 1.05 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.879 0.371 . . . . 0.0 110.658 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -163.45 142.8 8.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.968 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 12.0 p -145.7 17.94 1.47 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.165 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 105.16 -111.46 3.74 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.829 177.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 34.8 m -105.93 -9.85 10.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.64 0.257 . . . . 0.0 111.378 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 . . . . . 0 C--O 1.243 0.712 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.622 177.284 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.636 0.255 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -97.31 148.69 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.706 0.289 . . . . 0.0 110.379 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -131.69 117.81 19.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.13 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 17.3 m -86.55 131.73 34.09 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -65.6 -38.21 88.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.31 0.576 . . . . 0.0 109.752 174.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -136.42 112.5 9.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.405 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -104.19 -126.12 5.75 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.467 176.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 461' ' ' VAL . . . . . 0.41 ' HB ' ' OG ' ' B' ' 465' ' ' SER . 47.9 t -84.92 -34.84 9.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.92 0.39 . . . . 0.0 109.997 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 119.63 -122.78 5.41 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.595 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 463' ' ' THR . . . . . 0.428 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.0 OUTLIER -75.04 -26.33 59.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.337 . . . . 0.0 111.707 -176.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.48 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.1 mp0 -63.33 -40.84 98.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.127 177.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 465' ' ' SER . . . . . 0.41 ' OG ' ' HB ' ' B' ' 461' ' ' VAL . 12.1 m -68.06 -29.84 68.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.229 176.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' B' ' 463' ' ' THR . 54.4 tp -64.91 -46.22 82.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.745 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.503 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.8 t80 -52.59 -58.88 5.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.61 175.194 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.549 ' HE2' HD11 ' A' ' 201' ' ' ILE . 59.3 m-85 -62.62 -32.07 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.76 -45.27 90.58 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.032 0.444 . . . . 0.0 110.393 176.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -63.39 -43.44 97.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.421 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.0 t -57.63 -43.72 84.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.068 0.461 . . . . 0.0 110.444 177.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -56.74 -50.9 70.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.552 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -77.29 -24.59 50.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.607 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -78.45 -42.1 30.89 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.71 -44.94 22.36 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.998 -177.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 70.06 -55.49 0.6 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.912 0.757 . . . . 0.0 111.927 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 8.8 t -63.74 125.97 26.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.438 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.62 -46.16 84.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.312 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -31.27 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.36 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.86 -41.87 64.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.988 0.423 . . . . 0.0 110.942 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.54 -37.54 77.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.246 0.546 . . . . 0.0 109.748 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 28.8 tt0 -64.29 -38.57 91.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.405 175.5 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.442 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.9 t30 -58.03 -44.57 87.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.873 176.531 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -55.98 -45.79 78.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.166 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.614 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.7 mt -67.79 -29.13 68.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.227 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.686 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -62.99 -43.19 99.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.918 0.389 . . . . 0.0 110.101 173.62 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.63 -35.82 78.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.266 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.599 HD22 ' CD1' ' A' ' 200' ' ' PHE . 25.0 mt -66.52 -52.08 49.72 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.265 179.376 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 11.2 m -61.06 -41.91 91.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.563 HD13 ' HE1' ' A' ' 186' ' ' PHE . 18.7 pt -69.7 -27.49 33.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.838 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -67.89 -39.1 83.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 109.841 172.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -72.48 -35.28 68.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.261 -177.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.06 18.65 3.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.528 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 494' ' ' GLU . . . . . 0.431 ' HG3' ' HA ' ' A' ' 210' ' ' LYS . 13.7 tt0 56.26 49.11 15.89 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.162 0.506 . . . . 0.0 111.463 178.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 75.7 t -103.43 -49.26 10.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.582 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 44.8 pt -112.24 172.16 3.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.917 0.389 . . . . 0.0 110.966 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.409 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 18.9 p -109.43 179.73 4.06 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.786 176.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.521 ' O ' HG23 ' B' ' 502' ' ' VAL . 57.9 ttp180 -59.85 -47.83 84.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.775 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.76 70.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.784 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.474 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 5.4 mm-40 -56.36 -46.03 80.2 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.158 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.408 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 63.6 tp -58.31 -48.62 79.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.43 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.546 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 67.1 t -65.65 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.16 -177.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 89.2 mt-30 -77.04 -30.69 55.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -176.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.566 HD21 HD11 ' A' ' 153' ' ' LEU . 44.3 mt -66.73 -41.62 87.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.984 0.421 . . . . 0.0 111.78 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -86.94 10.41 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.353 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.672 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 78.2 p -64.77 -44.2 72.18 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.672 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 24.1 Cg_exo -67.46 -8.53 22.45 Favored 'Trans proline' 0 C--N 1.358 1.068 0 C-N-CA 122.086 1.858 . . . . 0.0 111.977 176.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -99.92 -67.9 0.83 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.753 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.612 HD22 HD23 ' B' ' 515' ' ' LEU . 67.0 mt -96.22 -8.1 33.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.438 -173.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.68 -16.31 61.01 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 121.093 -0.575 . . . . 0.0 113.043 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.592 ' HE3' ' O ' ' B' ' 507' ' ' PRO . 0.0 OUTLIER -87.76 -2.91 58.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.932 0.396 . . . . 0.0 110.518 178.184 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -117.77 96.78 50.02 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.732 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.52 -52.5 8.75 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.195 2.596 . . . . 0.0 112.879 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.21 -39.82 87.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.905 0.383 . . . . 0.0 111.461 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.612 HD23 HD22 ' B' ' 509' ' ' LEU . 25.4 tp -79.8 -44.1 21.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.957 -172.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.404 ' CD2' ' HE3' ' B' ' 520' ' ' LYS . 8.7 t80 -69.02 -32.98 72.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.284 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -73.77 -35.37 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.125 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.48 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 11.5 t90 -56.38 -48.82 76.08 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 173.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.546 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 21.6 t80 -55.92 -45.93 78.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.678 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' B' ' 516' ' ' PHE . 99.0 mttt -59.71 -47.93 83.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.107 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -62.21 -41.92 98.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -177.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -64.75 -35.54 81.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.052 0.453 . . . . 0.0 110.694 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.48 -7.15 57.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.172 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 68.41 26.82 74.09 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.969 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -86.26 130.49 34.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 110.531 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -128.27 147.09 50.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.382 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -107.98 12.34 27.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 110.526 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 12.4 p . . . . . 0 C--O 1.25 1.099 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.54 -179.969 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 127' ' ' SER . . . . . 0.725 ' HB3' ' HA2' ' A' ' 135' ' ' GLY . 16.0 m . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 121.123 0.487 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -123.26 -30.63 3.68 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.337 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.23 171.21 7.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.754 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' GLY . . . . . 0.641 ' HA3' ' HA ' ' A' ' 134' ' ' ASP . . . -168.64 116.31 0.66 Allowed Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.737 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 56.5 m -61.94 -28.12 69.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.389 . . . . 0.0 111.348 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -131.31 -60.25 0.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -119.03 131.71 56.0 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 171.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' ASP . . . . . 0.641 ' HA ' ' HA3' ' A' ' 130' ' ' GLY . 5.4 p-10 -69.41 134.6 49.2 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.152 0.501 . . . . 0.0 111.07 -176.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.725 ' HA2' ' HB3' ' A' ' 127' ' ' SER . . . 82.19 -8.32 61.23 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.121 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -144.46 38.69 1.28 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.727 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -92.49 2.33 56.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.857 0.361 . . . . 0.0 110.962 -177.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 37.4 m -95.05 111.37 54.47 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.221 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 5.1 Cg_exo -77.63 162.1 30.42 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.249 2.633 . . . . 0.0 111.606 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 58.3 t 61.57 91.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.093 0.473 . . . . 0.0 111.315 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.845 ' HG3' ' HD3' ' B' ' 476' ' ' ARG . 45.4 tt0 62.51 78.34 0.3 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.953 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -79.24 -11.62 59.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.409 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 48.9 mt -113.03 144.9 19.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' B' ' 477' ' ' SER . 18.5 t70 -104.93 -60.63 1.58 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 97.9 m -164.28 108.63 0.89 Allowed Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.776 177.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.17 143.03 82.76 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.241 1.96 . . . . 0.0 111.748 176.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -98.66 118.99 36.62 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.148 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.0 p -81.97 123.66 38.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.304 0.574 . . . . 0.0 110.792 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -89.39 131.26 35.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.177 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.465 ' HB2' HG13 ' A' ' 179' ' ' VAL . 96.8 mt -111.21 6.38 20.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.242 0.544 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -81.66 -26.73 34.51 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.559 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 28.0 pt20 -67.79 -22.51 65.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.578 175.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.628 HD21 HD21 ' B' ' 504' ' ' LEU . 30.8 mt -67.26 151.14 48.04 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 154' ' ' GLN . . . . . 0.488 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 50.9 mt-30 -63.83 148.46 49.26 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.528 HG12 ' HE ' ' A' ' 159' ' ' ARG . 48.3 t -56.96 -46.85 84.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.199 0.523 . . . . 0.0 109.892 178.297 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.17 -33.42 74.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.606 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.783 HG21 ' HG2' ' B' ' 500' ' ' GLU . 25.8 m -64.42 -45.67 86.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.897 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.6 mt -64.25 -37.32 87.05 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 110.519 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.528 ' HE ' HG12 ' A' ' 155' ' ' VAL . 74.2 mtt-85 -67.68 -38.13 83.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.53 176.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.6 ttm180 -65.2 -42.88 93.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.061 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.432 ' OH ' HD11 ' A' ' 189' ' ' ILE . 58.0 t80 -53.3 -47.81 68.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.916 173.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.644 ' NZ ' ' HB ' ' A' ' 181' ' ' ILE . 43.6 mttp -61.33 -49.43 77.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.823 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -63.79 -48.1 78.24 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -65.66 -41.77 92.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.91 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -87.0 3.22 46.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.666 -178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 55.74 60.58 3.22 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.043 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 162' ' ' LYS . 85.9 mt -94.45 130.7 32.91 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.957 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.33 125.24 15.85 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.163 1.909 . . . . 0.0 111.423 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.402 HG21 ' HD3' ' A' ' 162' ' ' LYS . 3.2 p -150.81 -175.52 5.16 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.938 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -132.3 147.05 64.16 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -59.3 131.91 43.62 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.345 2.03 . . . . 0.0 111.682 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.84 46.82 3.06 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.71 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 90.9 mt -75.46 152.02 37.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.042 0.449 . . . . 0.0 111.151 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.501 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 6.2 m-20 -104.21 164.74 11.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.529 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' A' ' 155' ' ' VAL . 5.8 tmtt? -56.33 -50.08 72.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.667 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.95 85.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.427 ' HA ' ' HG2' ' A' ' 180' ' ' GLU . 10.2 mm-40 -61.63 -41.71 97.87 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.555 0.693 . . . . 0.0 110.249 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 98.7 mt -61.85 -52.06 65.69 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.883 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.465 HG13 ' HB2' ' A' ' 150' ' ' LEU . 78.5 t -58.24 -48.99 83.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 O-C-N 123.614 0.571 . . . . 0.0 111.626 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.549 ' HG3' ' N ' ' A' ' 181' ' ' ILE . 6.7 pt-20 -62.02 -46.19 90.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.44 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.644 ' HB ' ' NZ ' ' A' ' 162' ' ' LYS . 80.6 mt -70.95 -39.27 74.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 120.622 0.249 . . . . 0.0 110.916 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 54.6 t -64.66 -47.55 88.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.94 -41.16 98.77 Favored Glycine 0 N--CA 1.449 -0.482 0 O-C-N 123.454 0.471 . . . . 0.0 112.432 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.7 t -59.19 -45.14 91.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.891 0.377 . . . . 0.0 110.544 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -78.27 -29.76 48.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.538 ' HE1' HD13 ' B' ' 490' ' ' ILE . 15.3 t80 -60.83 -39.02 87.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.683 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -75.78 6.6 4.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 p -128.88 21.09 5.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.922 0.392 . . . . 0.0 111.248 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.726 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.3 mt -88.85 118.35 69.2 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.417 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 190' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 5.3 Cg_exo -78.22 137.74 15.44 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.003 2.469 . . . . 0.0 111.569 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.506 HG11 ' HB3' ' B' ' 485' ' ' LEU . 0.0 OUTLIER -124.77 167.18 19.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.21 0.528 . . . . 0.0 111.786 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -125.28 110.38 13.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.684 174.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -48.36 -59.82 3.16 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.392 0.433 . . . . 0.0 111.766 -172.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -55.55 -57.37 12.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.68 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.43 -48.37 79.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.602 -173.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.1 m -63.59 -41.14 98.38 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.541 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 68.8 mt -65.17 -43.22 92.42 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.193 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.1 m -59.26 -41.09 87.98 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.699 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 91.7 m -58.36 -55.99 27.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 176.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.524 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 60.6 t80 -57.53 -50.81 71.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.399 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.482 HD11 ' HE2' ' B' ' 468' ' ' PHE . 63.9 mt -57.36 -55.13 22.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.766 -175.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.48 -32.74 70.39 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.0 m -70.45 -45.97 64.73 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.218 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.1 -27.96 20.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.974 0.416 . . . . 0.0 111.158 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 -72.55 -8.91 57.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.188 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -106.42 -51.51 2.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.745 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -159.66 -64.72 0.07 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.842 0.353 . . . . 0.0 110.951 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.642 ' HG3' ' H ' ' A' ' 209' ' ' ASN . 7.0 ptpp? -171.6 -65.35 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.747 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 209' ' ' ASN . . . . . 0.642 ' H ' ' HG3' ' A' ' 208' ' ' LYS . 24.1 p30 -155.15 161.14 41.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -88.68 84.53 6.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 22.3 m -109.32 5.22 23.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.721 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -105.94 111.78 24.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.793 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 92.0 mt -114.8 167.82 10.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.651 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -74.08 134.11 42.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.998 0.428 . . . . 0.0 111.165 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -135.25 -45.85 0.7 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.475 178.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -91.76 115.76 28.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 13.7 p -156.44 138.3 14.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.443 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -130.89 75.94 0.42 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.347 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 13.8 p -93.16 -25.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.491 0.186 . . . . 0.0 110.937 -177.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 . . . . . 0 C--O 1.251 1.144 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.895 -176.645 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 22.9 p . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 120.636 0.255 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -107.34 -50.3 3.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.807 0.337 . . . . 0.0 110.591 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -144.49 158.45 43.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.908 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 38.8 m -92.11 101.89 14.42 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.068 0.461 . . . . 0.0 110.622 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -86.63 165.8 15.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.189 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -71.59 -21.84 61.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.723 0.297 . . . . 0.0 110.384 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -77.97 93.73 1.19 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.761 176.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.36 -20.76 5.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.25 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -122.67 26.54 6.22 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.231 -0.748 . . . . 0.0 111.231 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.25 -38.0 85.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.366 . . . . 0.0 111.497 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.466 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.6 mp0 -58.56 -43.77 89.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.598 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 6.8 m -59.29 -44.07 92.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.028 0.442 . . . . 0.0 110.441 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.08 -49.83 76.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.815 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.4 t80 -53.03 -55.87 20.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.6 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.524 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 29.9 m-85 -63.92 -34.25 77.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.42 -43.65 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.542 -0.463 . . . . 0.0 109.985 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.56 -45.28 93.64 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 175.786 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.513 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -57.31 -49.41 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.987 0.422 . . . . 0.0 110.383 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -62.68 -38.41 90.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.838 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 tptp -80.35 -33.01 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.521 -174.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -80.56 -46.25 16.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.319 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.1 -46.66 87.73 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.7 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.845 ' HD3' ' HG3' ' A' ' 141' ' ' GLN . 51.1 mtt85 71.55 -49.24 0.68 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.74 0.65 . . . . 0.0 112.705 173.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.0 t -66.21 129.45 39.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.711 -178.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.34 70.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.727 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -75.55 -22.5 56.99 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.835 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -66.28 -51.41 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.133 0.492 . . . . 0.0 110.117 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' B' ' 485' ' ' LEU . 90.5 t80 -63.37 -40.64 97.8 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.945 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.572 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 38.1 tt0 -60.76 -42.78 98.11 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.865 177.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.418 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 6.9 t30 -59.38 -39.9 84.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.6 -45.95 81.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.389 0.614 . . . . 0.0 109.915 172.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.506 ' HB3' HG11 ' A' ' 191' ' ' VAL . 83.5 mt -67.02 -33.19 75.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.362 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.0 OUTLIER -57.75 -45.79 85.41 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.224 0.535 . . . . 0.0 109.867 174.132 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 36.4 m -59.69 -38.93 82.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.401 176.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.9 mt -65.34 -49.31 69.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 10.8 m -63.76 -42.89 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.665 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.538 HD13 ' HE1' ' A' ' 186' ' ' PHE . 26.5 pt -69.89 -28.53 37.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.874 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -67.61 -43.05 81.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.172 0.511 . . . . 0.0 110.344 174.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -79.49 -16.21 56.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.791 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -98.64 21.26 11.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.361 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 65.84 25.74 11.23 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.404 0.44 . . . . 0.0 112.103 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.569 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 89.2 t -92.25 -56.19 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.755 0.312 . . . . 0.0 110.663 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 32.8 pt -111.04 162.48 8.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.726 0.298 . . . . 0.0 110.289 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 8.9 t -105.82 -175.24 2.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.13 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.543 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.3 ttm180 -55.85 -51.65 66.77 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.677 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 499' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -50.46 -50.81 51.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.892 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.783 ' HG2' HG21 ' A' ' 157' ' ' THR . 3.8 mp0 -60.47 -45.17 94.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.939 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.615 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 64.9 tp -57.32 -46.0 83.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.029 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.784 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 54.5 t -64.54 -38.01 81.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.954 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.559 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 48.6 mt-30 -71.37 -42.48 68.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.912 -177.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.628 HD21 HD21 ' A' ' 153' ' ' LEU . 76.5 mt -63.33 -40.86 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.603 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.7 p -86.63 4.49 3.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.982 0.42 . . . . 0.0 111.262 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 24.0 t -59.0 -52.44 74.77 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.751 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' B' ' 506' ' ' SER . 10.8 Cg_endo -57.75 -18.35 33.5 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 122.082 1.854 . . . . 0.0 113.154 176.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.71 -52.0 5.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.603 ' HG ' HG22 ' B' ' 505' ' ' VAL . 62.4 mt -97.71 -11.72 23.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.536 -174.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.56 -14.04 64.14 Favored Glycine 0 C--O 1.23 -0.136 0 C-N-CA 121.391 -0.433 . . . . 0.0 112.875 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 53.1 mttm -77.22 -15.51 59.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.271 0.557 . . . . 0.0 109.659 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -124.08 96.89 41.55 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.247 -176.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -49.58 -48.3 19.56 Favored 'Trans proline' 0 CA--C 1.529 0.253 0 C-N-CA 123.234 2.622 . . . . 0.0 113.504 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -66.94 -40.6 87.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.985 0.421 . . . . 0.0 111.088 -177.32 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 18.5 tp -69.23 -44.84 71.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.523 -175.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -68.31 -32.88 73.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.087 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -63.5 -43.0 98.48 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.466 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 12.4 t90 -57.28 -49.06 77.26 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.846 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.784 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 66.9 t80 -59.04 -46.72 87.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.145 -178.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -64.17 -36.25 83.46 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.968 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -72.01 -37.42 69.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.108 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -66.87 -34.35 77.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.28 0.562 . . . . 0.0 110.583 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.484 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 9.0 mp -83.93 -14.65 50.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.038 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.97 35.82 61.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.139 -174.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -77.5 114.84 16.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.253 -0.473 . . . . 0.0 110.468 -177.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -100.16 147.04 26.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.967 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -107.17 75.95 1.06 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.4 0.619 . . . . 0.0 110.786 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 34.5 t . . . . . 0 C--O 1.251 1.174 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.881 177.021 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 120.667 0.27 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -82.8 160.28 22.28 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.816 0.341 . . . . 0.0 110.694 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -90.54 120.69 31.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.041 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -140.32 175.61 21.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.5 t -134.82 104.24 5.93 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -155.76 159.41 39.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.211 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -136.63 -45.02 0.6 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.071 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -74.84 157.66 34.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.368 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 164.9 149.71 5.92 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.921 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.24 24.15 76.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.292 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -92.37 148.68 21.93 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 27.3 t -76.0 112.69 21.73 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 6.8 Cg_exo -74.22 -17.59 21.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.956 2.437 . . . . 0.0 112.519 -176.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 18.3 m -126.12 164.87 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.177 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -164.81 95.77 0.71 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.165 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -102.48 -34.62 9.07 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 37.6 mt 71.8 136.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 114.631 -1.168 . . . . 0.0 111.634 178.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -93.7 -68.17 0.82 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.028 176.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.9 m -154.89 114.08 2.37 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.432 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -57.91 133.26 54.74 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.367 2.044 . . . . 0.0 111.296 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.42 110.09 6.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.302 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -73.7 110.36 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.573 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 18.9 t0 -72.38 88.15 1.18 Allowed 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.555 HD23 HD22 ' B' ' 504' ' ' LEU . 95.7 mt -89.57 -8.06 53.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.818 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -82.69 -23.06 34.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.865 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.573 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 4.7 pt20 -74.2 -18.94 60.69 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.86 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.3 mt -65.79 155.27 36.71 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.742 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -71.26 158.93 35.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.159 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.411 HG13 ' CD1' ' A' ' 178' ' ' LEU . 16.6 t -60.67 -46.32 96.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 109.972 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ASN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 159' ' ' ARG . 84.7 m-20 -67.71 -21.34 65.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.733 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.3 m -69.5 -51.32 36.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.183 0.516 . . . . 0.0 110.468 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 30.7 mt -65.96 -32.58 74.16 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 122.034 0.921 . . . . 0.0 109.57 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.545 ' HB3' ' HA ' ' A' ' 156' ' ' ASN . 77.8 ttt180 -63.08 -43.37 98.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.581 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 17.8 ttm180 -69.5 -37.73 77.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.543 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.463 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 70.9 t80 -51.53 -57.37 9.25 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.605 0.24 . . . . 0.0 110.7 174.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 7.1 ptpp? -66.96 -27.02 67.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.794 0.33 . . . . 0.0 111.13 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -69.43 -47.95 62.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.777 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -71.93 -45.44 61.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.042 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.431 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 70.8 m-85 -81.74 1.91 32.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.331 -177.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 57.4 74.47 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.25 176.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.68 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 90.0 mt -111.45 106.86 57.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.944 177.734 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.473 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -58.63 126.02 20.04 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.305 2.003 . . . . 0.0 111.39 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.65 ' HB ' HD11 ' A' ' 173' ' ' LEU . 3.1 p -133.35 165.36 25.01 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.125 -176.173 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -107.28 140.91 21.93 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -56.66 137.24 80.22 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.755 2.303 . . . . 0.0 112.488 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 99.9 42.47 2.64 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.337 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.65 HD11 ' HB ' ' A' ' 169' ' ' THR . 95.8 mt -85.93 145.67 27.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.95 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.654 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 18.0 m120 -102.04 169.59 8.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.999 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.5 tptm -59.87 -54.24 48.5 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.317 -178.142 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.79 -33.39 72.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.982 0.42 . . . . 0.0 110.66 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.654 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 85.4 mm-40 -62.0 -45.06 95.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.304 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 62.7 mt -59.14 -47.49 85.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.518 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 175' ' ' LYS . 18.3 t -59.29 -45.05 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.072 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -61.64 -46.13 91.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.17 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 86.8 mt -58.49 -45.84 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-O 121.165 0.507 . . . . 0.0 110.426 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.569 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 70.3 t -62.22 -48.63 87.52 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.991 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -65.02 -38.89 95.97 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.384 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 48.2 t -59.03 -43.29 91.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.801 0.334 . . . . 0.0 110.811 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -84.47 -23.23 29.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 110.951 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.569 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 20.7 t80 -64.41 -41.62 96.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.799 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -70.62 -18.35 62.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.677 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 14.9 p -106.5 27.41 8.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.636 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.9 mt -89.9 114.07 59.4 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.547 0.213 . . . . 0.0 110.448 175.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -68.49 103.92 1.03 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.436 2.091 . . . . 0.0 111.663 177.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.63 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.9 p -110.47 156.85 11.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -127.81 126.23 41.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.4 tt0 -50.9 -59.71 3.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.92 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.91 -57.16 13.83 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.62 -39.59 84.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 -171.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 95.6 m -67.58 -38.63 84.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.611 -178.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 39.6 mt -63.41 -46.11 87.9 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 174.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.6 m -59.09 -40.55 85.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.535 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 21.1 m -57.56 -55.79 30.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.248 177.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.552 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.5 t80 -62.09 -51.58 67.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.235 -175.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.55 -48.88 85.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.78 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -71.43 -31.2 66.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.081 -174.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.5 m -72.7 -53.97 10.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.198 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.518 HG11 HD23 ' B' ' 523' ' ' LEU . 54.4 t -65.29 -36.09 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.658 -174.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -72.33 -8.17 53.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 111.079 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -101.88 -52.85 3.08 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 9.4 t70 -166.6 -159.74 0.37 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 523' ' ' LEU . 25.2 mtmm -135.34 131.89 36.97 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 121.95 -0.469 . . . . 0.0 111.07 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 10.6 m120 68.42 -76.34 0.06 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.982 0.801 . . . . 0.0 110.688 -177.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 82.6 tttt 68.55 158.29 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.094 0.558 . . . . 0.0 111.422 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 16.5 t 67.29 32.85 5.72 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.731 0.776 . . . . 0.0 109.843 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -81.37 40.93 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.893 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 49.3 tp -71.91 134.82 46.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.501 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm 71.36 99.17 0.07 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.992 0.807 . . . . 0.0 110.423 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -78.48 -22.36 47.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.439 -175.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -80.85 140.01 35.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 110.424 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 19.6 m -135.62 32.44 3.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.33 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -80.2 56.55 4.63 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.663 -178.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.2 176.72 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.823 0.344 . . . . 0.0 110.89 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 . . . . . 0 C--O 1.245 0.818 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.85 -178.175 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 21.7 p . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 110.566 -0.161 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 67.32 175.63 0.25 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.21 0.604 . . . . 0.0 111.389 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -125.0 -32.11 3.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.731 0.301 . . . . 0.0 111.624 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 18.3 m -133.48 133.55 42.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.626 -178.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -76.79 145.9 38.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.613 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -122.37 -170.1 2.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.245 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 118.85 -132.08 9.48 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.673 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 39.7 t -90.92 84.44 2.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.311 0.577 . . . . 0.0 109.978 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -156.54 26.07 0.52 Allowed Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.124 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.6 t -76.86 -24.17 52.64 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -64.16 -47.91 78.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.663 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.2 m -60.77 -35.11 75.61 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.241 177.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 35.9 tp -63.08 -52.33 63.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.153 176.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.8 t80 -52.54 -57.89 8.53 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.95 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.401 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.8 m-85 -64.39 -34.53 78.38 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.089 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.4 -40.63 96.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.252 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.1 mttt -68.27 -34.92 77.06 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.696 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -63.1 -42.92 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.073 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.24 92.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.441 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -74.35 -36.55 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.185 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.574 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -66.6 -48.95 67.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.69 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 475' ' ' LEU . . . . . 0.435 HD23 ' O ' ' B' ' 480' ' ' ALA . 10.3 mp -71.43 -37.15 71.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.026 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 71.89 -60.83 0.51 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 124.134 0.896 . . . . 0.0 112.642 170.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 45.4 m -67.51 139.45 56.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.945 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -58.03 -44.72 87.51 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.06 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -65.12 -39.11 92.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.557 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.435 ' O ' HD23 ' B' ' 475' ' ' LEU . . . -62.09 -51.57 67.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.871 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -65.84 -36.94 84.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.215 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.684 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 30.3 tt0 -59.44 -42.13 91.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 175.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.65 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.1 t30 -60.8 -43.29 98.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.98 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.8 -45.19 70.7 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.325 0.583 . . . . 0.0 110.359 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 191' ' ' VAL . 86.2 mt -67.53 -31.81 72.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.466 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.684 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -63.39 -36.91 85.28 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.218 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.1 m -65.14 -36.2 83.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.897 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.552 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.3 mt -65.25 -48.55 72.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.337 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 13.9 m -65.04 -42.26 94.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.828 -177.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 186' ' ' PHE . 38.7 pt -69.15 -30.74 47.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.169 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -68.37 -45.01 73.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.111 0.481 . . . . 0.0 110.242 173.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -62.24 -38.8 90.61 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.991 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -86.31 16.28 4.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.698 -176.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 494' ' ' GLU . . . . . 0.427 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 0.1 OUTLIER 63.08 38.95 10.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.985 0.421 . . . . 0.0 111.045 174.926 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.581 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.9 t -96.7 -33.71 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.255 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 39.0 pt -124.73 153.32 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.929 0.395 . . . . 0.0 111.212 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 46.2 m -80.02 166.23 21.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.019 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.524 ' O ' HG23 ' B' ' 502' ' ' VAL . 20.7 ttm180 -54.92 -53.98 48.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.765 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.56 85.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.823 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.0 mm-40 -55.48 -46.29 76.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.67 -51.12 71.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.038 0.447 . . . . 0.0 110.99 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 498' ' ' ARG . 59.9 t -60.09 -35.44 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.667 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -67.42 -42.25 83.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.91 178.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.555 HD22 HD23 ' A' ' 150' ' ' LEU . 93.8 mt -66.77 -39.91 88.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 111.508 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.431 HG11 ' CE2' ' B' ' 519' ' ' PHE . 4.6 p -85.14 2.43 4.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.035 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.704 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 14.2 t -58.49 -53.84 62.1 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.357 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 31.8 Cg_exo -61.83 -26.66 79.57 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.744 1.629 . . . . 0.0 112.143 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -73.93 -60.59 2.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.575 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.575 HD22 HD23 ' B' ' 515' ' ' LEU . 78.8 mt -102.28 -10.39 19.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -172.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.21 -21.76 64.43 Favored Glycine 0 C--O 1.229 -0.166 0 C-N-CA 121.229 -0.51 . . . . 0.0 113.312 -176.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -81.98 0.95 37.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.079 0.466 . . . . 0.0 110.79 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.574 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 50.2 m-85 -125.58 90.29 50.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 174.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 -45.7 27.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.484 2.79 . . . . 0.0 113.602 -174.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.29 -45.23 73.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.975 0.417 . . . . 0.0 110.659 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.575 HD23 HD22 ' B' ' 509' ' ' LEU . 15.5 tp -67.89 -43.13 80.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.635 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 25.8 t80 -67.29 -38.84 85.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.446 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.69 -37.78 85.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.491 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.61 -49.3 75.35 Favored 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.431 ' CE2' HG11 ' B' ' 505' ' ' VAL . 66.0 t80 -58.86 -45.9 89.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.859 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.429 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 58.3 mtpt -62.95 -42.71 99.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.874 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 521' ' ' ASN . . . . . 0.409 HD22 ' C ' ' B' ' 521' ' ' ASN . 0.2 OUTLIER -66.44 -35.5 80.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.988 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.21 -42.72 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.346 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.539 ' O ' ' HD3' ' A' ' 208' ' ' LYS . 81.8 mt -78.21 -14.96 59.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.374 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 78.15 15.98 80.33 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.345 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -85.69 104.99 15.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -92.64 105.96 18.02 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.655 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -142.32 68.24 1.32 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.08 -175.052 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -59.6 -55.95 28.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.965 0.412 . . . . 0.0 110.941 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -140.42 -163.58 1.55 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.285 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -62.24 -33.13 85.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.171 -0.538 . . . . 0.0 111.894 177.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -67.87 103.61 1.5 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -67.14 160.46 26.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.538 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -77.66 -4.22 44.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.083 -174.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 16.5 t70 60.11 86.07 0.1 Allowed 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.773 0.671 . . . . 0.0 110.646 -177.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -165.31 101.42 0.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.884 -178.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -124.23 26.95 5.69 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 121.084 -0.579 . . . . 0.0 111.862 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -81.02 -47.0 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.17 0.509 . . . . 0.0 110.376 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.1 p -160.77 141.79 8.78 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.749 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.9 173.91 13.69 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.426 2.084 . . . . 0.0 111.959 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 16.0 m -93.7 35.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.242 -176.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 54.4 68.19 0.9 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.507 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -81.59 -3.19 52.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.982 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.428 HG21 ' HG3' ' A' ' 146' ' ' PRO . 16.7 mt -73.52 137.56 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.479 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -98.36 -57.9 2.09 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.3 m -163.3 113.08 1.02 Allowed Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.459 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.428 ' HG3' HG21 ' A' ' 143' ' ' ILE . 3.5 Cg_exo -73.72 155.63 49.17 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.534 2.156 . . . . 0.0 111.159 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -123.02 145.93 48.09 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.772 0.32 . . . . 0.0 111.256 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.87 125.23 51.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.91 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.438 ' HB2' ' OE1' ' A' ' 152' ' ' GLN . 11.0 m-20 -72.96 -30.49 63.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.687 -174.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.439 HD23 HD22 ' B' ' 504' ' ' LEU . 64.8 mt 60.5 7.16 1.26 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.114 -176.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -75.14 -26.42 59.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.457 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.6 OUTLIER -61.59 -17.87 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.076 -177.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.591 ' O ' ' HB ' ' A' ' 157' ' ' THR . 28.1 mt -80.42 4.6 17.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 154' ' ' GLN . . . . . 0.607 ' HA ' ' HE2' ' A' ' 175' ' ' LYS . 21.0 mm-40 55.61 -170.79 0.07 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.609 HG12 HD12 ' A' ' 178' ' ' LEU . 1.6 m -77.85 -37.64 23.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 121.632 -0.667 . . . . 0.0 110.776 172.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -58.21 -53.69 55.43 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' A' ' 153' ' ' LEU . 41.9 m -70.57 -34.68 72.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.641 0.258 . . . . 0.0 111.388 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 82.8 mt -63.06 -40.18 96.92 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.351 0.596 . . . . 0.0 110.523 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.2 mtt180 -69.88 -31.4 69.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.815 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 29.4 ttm180 -68.27 -42.37 79.65 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -52.05 -51.25 58.72 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.451 ' NZ ' HG23 ' A' ' 182' ' ' VAL . 54.4 mttp -61.01 -43.65 98.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.745 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -70.38 -38.87 74.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.29 -175.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -79.53 -35.52 39.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -176.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 59.3 m-85 -92.75 1.69 57.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 59.34 79.89 0.21 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.804 0.69 . . . . 0.0 111.38 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.439 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 96.8 mt -120.17 100.37 47.93 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.92 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -61.59 125.65 17.23 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.382 2.055 . . . . 0.0 111.657 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -130.69 137.85 49.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.883 -175.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.603 ' HD2' ' H ' ' A' ' 170' ' ' ARG . 0.1 OUTLIER -66.22 146.04 99.01 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.509 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 171' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 27.9 Cg_exo -62.53 126.82 19.21 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.614 2.209 . . . . 0.0 112.104 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 114.05 51.99 0.47 Allowed Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.594 -178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 96.4 mt -89.1 164.94 14.81 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.073 0.463 . . . . 0.0 111.216 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.599 ' HB3' ' HG2' ' A' ' 177' ' ' GLN . 56.5 t30 -142.0 165.5 27.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.257 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 154' ' ' GLN . 27.2 tptp -50.22 -54.85 18.14 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 122.84 0.456 . . . . 0.0 111.546 -178.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.49 93.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.332 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.599 ' HG2' ' HB3' ' A' ' 174' ' ' ASN . 8.6 mm100 -64.42 -38.56 91.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.54 0.686 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.609 HD12 HG12 ' A' ' 155' ' ' VAL . 96.6 mt -61.9 -44.86 95.93 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.929 176.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.27 -50.34 80.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 O-C-N 123.58 0.55 . . . . 0.0 111.36 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -56.41 -53.71 54.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.619 0.247 . . . . 0.0 111.476 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 64.1 mt -62.63 -40.71 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-O 120.714 0.292 . . . . 0.0 111.036 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.451 HG23 ' NZ ' ' A' ' 162' ' ' LYS . 39.2 t -64.64 -47.82 87.32 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.22 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.32 -36.28 92.84 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.349 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.2 t -58.63 -47.4 84.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.317 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -80.13 -28.44 38.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -61.0 -47.68 85.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.137 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -74.53 -3.66 32.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -106.94 17.29 23.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.991 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.675 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.4 mt -87.98 117.74 68.82 Favored Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.881 178.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 190' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 3.3 Cg_exo -74.64 100.07 1.29 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.863 2.375 . . . . 0.0 111.0 175.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.445 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 13.3 p -115.46 135.2 56.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.061 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -108.05 125.72 51.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.027 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.465 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.0 tt0 -50.97 -59.71 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 123.63 0.581 . . . . 0.0 112.39 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -51.8 -58.21 7.09 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.656 0.614 . . . . 0.0 112.656 -173.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.02 -41.5 97.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.084 -176.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 54.7 m -65.92 -42.85 89.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 201' ' ' ILE . 53.1 mt -59.46 -43.84 93.11 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 41.8 m -59.5 -48.41 81.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.771 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.96 -49.15 78.94 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.788 0.328 . . . . 0.0 110.626 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' B' ' 488' ' ' LEU . 46.2 t80 -59.35 -60.39 3.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.699 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.511 HD11 ' HE2' ' B' ' 468' ' ' PHE . 46.9 mt -58.11 -44.7 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.002 0.43 . . . . 0.0 110.497 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -61.87 -41.21 97.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.966 -178.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -63.56 -51.67 64.39 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.801 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.3 t -65.69 -28.8 45.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.226 -175.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -84.62 -1.21 55.67 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -116.77 -46.46 2.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.427 173.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.786 ' HB3' ' HB3' ' A' ' 210' ' ' LYS . 15.8 t70 -172.78 137.34 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -77.27 91.33 3.78 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.495 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 64.3 t30 62.72 78.68 0.28 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.785 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.786 ' HB3' ' HB3' ' A' ' 207' ' ' ASP . 14.5 ptmm? -82.92 139.95 33.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.37 -175.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 26.7 m -78.36 160.97 27.51 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.839 174.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -82.12 122.3 27.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.588 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 80.3 mt -116.56 97.88 6.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.633 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 214' ' ' LYS . . . . . 0.402 ' HB3' ' OD2' ' A' ' 216' ' ' ASP . 65.3 mttp -78.47 -55.94 4.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.56 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 62.43 20.62 12.02 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.539 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 216' ' ' ASP . . . . . 0.402 ' OD2' ' HB3' ' A' ' 214' ' ' LYS . 40.3 m-20 -76.02 -33.82 59.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.245 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 34.8 p 47.16 76.16 0.11 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.208 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -98.88 -72.98 1.07 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.731 -0.947 . . . . 0.0 110.731 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 32.7 t 58.55 88.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.427 0.632 . . . . 0.0 111.784 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.709 -0.662 . . . . 0.0 109.581 176.845 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 120.692 0.282 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -93.15 101.67 13.96 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -85.15 117.49 24.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 48.2 t -103.21 -44.85 5.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.108 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -162.99 -48.84 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.413 -176.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -59.67 108.93 0.81 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.802 -178.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 137.74 -33.31 2.28 Favored Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.747 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.81 128.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.007 0.432 . . . . 0.0 111.013 -178.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 144.36 30.83 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.444 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.8 p -70.09 -22.78 63.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.062 0.458 . . . . 0.0 110.975 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.16 -42.84 91.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.791 176.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 5.8 t -64.15 -35.74 81.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.284 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.36 -44.44 96.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.099 177.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.543 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.3 t80 -53.24 -55.02 27.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.511 ' HE2' HD11 ' A' ' 201' ' ' ILE . 63.5 m-85 -65.49 -32.35 73.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.13 -40.51 97.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.531 . . . . 0.0 110.253 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -68.19 -44.12 76.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.537 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.543 HG23 ' O ' ' B' ' 467' ' ' PHE . 59.8 t -55.12 -43.64 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.188 0.518 . . . . 0.0 110.052 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 28.9 mtt-85 -57.09 -53.0 63.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.799 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -73.28 -33.63 65.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.729 -174.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.572 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -73.62 -47.93 36.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.773 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.8 mp -69.26 -34.45 74.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.791 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 71.65 -40.54 0.48 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.937 0.773 . . . . 0.0 112.298 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 22.8 t -83.97 127.98 34.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.829 0.347 . . . . 0.0 110.387 -175.314 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.93 -46.51 84.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.664 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.21 -24.91 61.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.07 -176.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.86 -42.02 81.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.129 0.49 . . . . 0.0 109.826 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -66.69 -35.58 80.48 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 41.6 tt0 -62.52 -43.07 99.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.231 175.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.3 -45.87 72.66 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.628 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.559 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 82.3 t80 -54.98 -49.05 72.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.3 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 193' ' ' GLU . 89.1 mt -63.94 -34.47 78.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.548 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.675 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.5 mtt180 -67.66 -36.8 81.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.101 0.477 . . . . 0.0 110.349 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.53 -34.03 76.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.707 174.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 200' ' ' PHE . 50.5 mt -68.04 -44.2 76.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.412 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.477 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.8 m -66.72 -42.87 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.401 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.433 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 19.3 pt -69.66 -26.79 31.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.752 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -67.88 -39.33 83.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.102 0.477 . . . . 0.0 110.149 173.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -71.69 -26.12 62.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.965 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -93.6 18.07 10.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 64.78 14.58 9.25 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.562 0.538 . . . . 0.0 111.762 176.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.548 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 62.0 t -76.37 -41.5 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.852 0.358 . . . . 0.0 110.355 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.44 HG22 ' CG2' ' A' ' 157' ' ' THR . 37.1 pt -122.39 169.63 13.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.975 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 9.0 t -121.01 -176.0 3.17 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.618 ' HG3' ' HB3' ' B' ' 523' ' ' LEU . 22.9 ttm180 -57.53 -48.13 80.13 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.164 0.29 . . . . 0.0 111.639 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 499' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -56.79 -54.55 45.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.742 -174.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 1.7 pm0 -69.69 -32.49 71.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.522 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 61.5 tp -58.32 -49.71 76.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.807 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 99.3 t -64.07 -39.81 86.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.676 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.457 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 98.4 mt-30 -71.3 -24.96 62.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.093 -178.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 79.7 mt -70.46 -40.46 73.7 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.154 -0.341 . . . . 0.0 111.233 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.528 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.5 p -91.16 5.33 5.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 110.552 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.558 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 9.5 t -58.41 -48.64 96.59 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.345 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.7 Cg_exo -61.93 -9.3 13.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 122.353 2.036 . . . . 0.0 112.998 176.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -107.25 -60.03 1.74 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.252 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.528 ' HG ' HG22 ' B' ' 505' ' ' VAL . 82.6 mt -90.25 -12.75 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.943 -175.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -68.03 -7.07 48.82 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.706 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 52.1 mttm -84.92 -17.35 38.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.236 0.541 . . . . 0.0 109.739 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.572 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 51.2 m-85 -122.48 97.93 44.23 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.136 -175.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.6 -52.18 9.46 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 123.437 2.758 . . . . 0.0 113.596 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -66.85 -30.78 71.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 111.3 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 29.6 tp -78.09 -43.78 28.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.189 0.519 . . . . 0.0 109.988 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 9.2 t80 -67.8 -31.86 72.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.719 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -66.86 -42.92 84.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.794 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -54.18 -49.79 68.51 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.807 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 73.5 t80 -58.78 -59.48 5.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.87 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -57.0 -40.21 76.17 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -176.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -62.84 -37.7 87.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.937 0.399 . . . . 0.0 110.653 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -67.83 -47.23 69.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.902 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.618 ' HB3' ' HG3' ' B' ' 498' ' ' ARG . 3.8 mm? -70.57 -17.4 62.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.887 -177.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.91 32.59 12.44 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.382 -175.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -101.28 95.32 6.44 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 66.5 tttp -68.73 -18.69 64.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.481 -174.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 65.69 59.52 0.75 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 29.4 m . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.41 -178.273 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -88.1 -24.41 23.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.653 0.264 . . . . 0.0 111.276 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -124.38 120.65 32.73 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.529 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -120.84 152.97 16.72 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -141.28 88.5 2.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 110.278 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.66 124.13 24.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -100.6 139.27 36.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.91 0.386 . . . . 0.0 111.017 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -130.07 22.35 5.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.939 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.73 97.88 2.52 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.891 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.17 144.39 46.15 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.413 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -99.2 18.55 17.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.779 0.323 . . . . 0.0 110.759 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 32.8 t -54.12 131.79 59.83 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.869 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.45 127.61 26.94 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.92 2.414 . . . . 0.0 112.005 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 61.5 t 60.52 88.26 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.506 -173.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -89.72 94.97 10.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -95.49 -19.13 20.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.707 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 42.2 mt 70.99 144.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.551 177.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -88.8 -65.27 1.03 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 98.9 m -160.5 112.88 1.36 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.52 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 26.7 Cg_exo -62.32 136.49 60.0 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.444 2.096 . . . . 0.0 111.285 177.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -95.86 133.67 39.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.245 0.545 . . . . 0.0 111.856 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 p -92.75 102.97 14.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.457 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.61 117.93 13.79 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.54 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.45 1.9 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.13 0.49 . . . . 0.0 110.764 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -80.37 -26.99 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.729 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.621 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 6.1 pt20 -67.45 -20.91 65.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.153 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.554 HD11 HD21 ' B' ' 504' ' ' LEU . 73.0 mt -72.11 165.81 23.58 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.368 0.604 . . . . 0.0 112.182 -174.214 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 154' ' ' GLN . . . . . 0.55 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 98.3 mt-30 -72.2 154.15 41.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.552 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.1 t -63.12 -46.01 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.029 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -61.48 -33.15 73.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.631 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.55 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 48.2 m -61.93 -50.92 70.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.012 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.3 -39.4 93.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.126 0.489 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -67.96 -30.39 69.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.765 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.555 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.9 ttm180 -70.4 -40.86 73.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.57 ' HA ' HG13 ' B' ' 495' ' ' VAL . 61.6 t80 -57.03 -52.25 66.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.27 173.576 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.57 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.2 mtpm? -59.63 -33.62 71.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.992 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -78.19 -42.96 29.89 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.769 0.319 . . . . 0.0 111.232 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -67.07 -42.42 84.74 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -178.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -92.47 -1.38 57.02 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm 58.2 79.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.504 0.503 . . . . 0.0 111.597 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.735 HD23 HG22 ' A' ' 181' ' ' ILE . 11.0 mp -103.27 120.02 53.33 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.76 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 12.9 Cg_exo -68.97 129.71 18.94 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 123.572 2.848 . . . . 0.0 112.464 -175.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.448 HG21 HD11 ' A' ' 173' ' ' LEU . 8.9 t -178.48 169.57 1.75 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.925 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 171' ' ' PRO . 16.4 ptp180 -82.6 147.3 55.36 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.375 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 15.5 Cg_exo -69.36 132.65 24.43 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.684 2.256 . . . . 0.0 112.195 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.35 55.42 0.91 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.58 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.448 HD11 HG21 ' A' ' 169' ' ' THR . 81.9 mt -95.03 148.25 22.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.622 0.248 . . . . 0.0 110.644 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.453 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 31.5 m-80 -85.43 177.9 7.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.612 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.635 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.9 tptm -57.8 -52.59 64.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.388 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.8 -40.26 79.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 111.159 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -59.56 -48.02 83.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.332 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 91.2 mt -60.49 -48.71 80.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.138 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.2 t -58.8 -46.68 90.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.302 -175.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.29 -39.32 82.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 -177.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.735 HG22 HD23 ' A' ' 167' ' ' LEU . 70.7 mt -67.78 -47.34 80.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 120.805 0.336 . . . . 0.0 110.748 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.62 -47.29 85.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.78 -36.07 92.2 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.563 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 25.0 t -62.58 -39.54 94.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.853 0.359 . . . . 0.0 110.683 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -85.86 -31.75 22.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.765 0.317 . . . . 0.0 110.995 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -63.54 -40.54 97.3 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.843 0.457 . . . . 0.0 112.131 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -74.41 -6.55 48.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 111.55 -177.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 62.8 m -111.89 23.38 13.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.883 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 76.0 mt -84.17 116.04 63.01 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.672 0.272 . . . . 0.0 110.953 177.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 190' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 6.2 Cg_exo -74.41 105.59 2.08 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.073 2.516 . . . . 0.0 110.751 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.8 p -108.65 143.43 18.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.895 0.378 . . . . 0.0 111.368 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -110.78 113.24 25.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.943 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 47.7 tt0 -46.01 -60.28 2.36 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -60.17 -53.68 54.8 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -63.96 -39.51 94.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.884 0.373 . . . . 0.0 110.834 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 75.4 m -64.74 -43.73 92.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 -178.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 63.6 mt -60.82 -45.06 95.9 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -56.91 -47.0 81.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.675 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 83.2 m -61.09 -50.78 71.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.417 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.581 ' CD1' HD22 ' B' ' 488' ' ' LEU . 87.1 t80 -60.93 -49.71 76.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.081 -177.485 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.459 HD11 ' HE2' ' B' ' 468' ' ' PHE . 83.9 mt -57.71 -49.95 79.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.382 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 202' ' ' TYR . . . . . 0.411 ' O ' ' HB2' ' A' ' 206' ' ' ASN . 7.9 m-85 -63.27 -33.11 74.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.419 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 42.4 m -69.2 -53.21 21.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.709 0.29 . . . . 0.0 110.715 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 200' ' ' PHE . 15.2 t -66.72 -25.42 34.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.787 0.327 . . . . 0.0 110.987 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.4 1.01 54.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.567 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 206' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 202' ' ' TYR . 0.3 OUTLIER -138.62 -82.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.515 0.198 . . . . 0.0 111.137 178.28 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -119.66 109.03 15.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.64 -56.51 20.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.448 . . . . 0.0 110.941 -177.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -161.82 29.46 0.12 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.429 0.633 . . . . 0.0 109.875 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.415 ' C ' ' HD2' ' A' ' 210' ' ' LYS . 0.0 OUTLIER -135.26 -178.53 5.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.081 -176.097 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 5.2 p -151.92 100.38 2.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.115 0.483 . . . . 0.0 111.071 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -129.59 2.17 5.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.276 178.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 213' ' ' LEU . . . . . 0.424 HD13 ' HA ' ' A' ' 213' ' ' LEU . 4.1 mm? -89.62 97.21 11.07 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.127 0.489 . . . . 0.0 110.291 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 214' ' ' LYS . . . . . 0.526 ' HA ' ' HE3' ' A' ' 214' ' ' LYS . 0.1 OUTLIER -110.08 102.27 11.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.778 179.46 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -88.64 163.12 15.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.494 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.22 -175.8 5.16 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.104 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 50.3 m -147.04 105.24 3.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.94 0.4 . . . . 0.0 110.295 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -98.39 159.95 20.53 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.981 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 11.2 p -83.02 -30.64 8.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.057 0.456 . . . . 0.0 110.267 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.682 -178.915 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 21.6 t . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.068 0.461 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -88.18 115.26 25.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.325 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -120.81 -32.87 3.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.38 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 47.8 m 57.29 52.27 9.02 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.142 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -126.91 171.17 11.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.659 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.7 p80 -137.6 160.75 38.31 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 130.89 -84.92 0.3 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.977 176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 35.8 m -118.12 162.37 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 120.601 0.239 . . . . 0.0 110.605 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -177.32 -54.5 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.852 177.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 463' ' ' THR . . . . . 0.471 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 2.8 p -63.92 -35.79 81.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.463 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -68.28 -42.82 78.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.221 177.436 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -64.39 -35.53 81.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.022 0.439 . . . . 0.0 110.071 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' B' ' 463' ' ' THR . 18.8 tp -55.13 -53.51 55.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.915 174.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.536 ' CE1' ' HG ' ' B' ' 515' ' ' LEU . 79.4 t80 -54.15 -52.24 61.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.049 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.459 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.1 m-85 -64.79 -34.99 79.66 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.95 -43.12 93.77 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.33 0.586 . . . . 0.0 109.9 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.97 -45.6 94.11 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.146 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 467' ' ' PHE . 94.0 t -58.89 -40.57 80.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.533 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -54.07 -48.28 70.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.262 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 473' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 476' ' ' ARG . 81.8 tttt -82.94 -35.02 26.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -178.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -66.71 -49.2 66.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 475' ' ' LEU . . . . . 0.413 HD13 HG13 ' B' ' 471' ' ' VAL . 8.6 mp -67.47 -34.05 76.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.481 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' B' ' 473' ' ' LYS . 38.4 mtm180 69.0 -58.1 0.5 Allowed 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.968 0.792 . . . . 0.0 112.377 176.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.0 t -67.54 129.96 41.55 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.849 0.357 . . . . 0.0 110.191 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.22 71.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.496 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.47 -36.62 74.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.111 0.482 . . . . 0.0 109.871 176.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.542 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.41 -45.73 78.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.4 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.416 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 70.5 t80 -65.29 -39.5 92.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.105 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 36.8 tt0 -59.25 -42.68 91.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.243 175.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.62 -43.05 99.57 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -56.4 -45.88 80.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 174.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.473 ' HB3' HG21 ' A' ' 191' ' ' VAL . 93.1 mt -66.12 -33.37 75.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.927 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.883 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 10.7 mtt85 -66.52 -36.7 83.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.052 0.453 . . . . 0.0 110.178 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.2 m -61.21 -37.24 82.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.119 0.485 . . . . 0.0 109.776 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 200' ' ' PHE . 38.6 mt -64.92 -46.99 79.36 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.473 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 17.1 m -64.18 -41.26 91.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.562 -178.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 30.0 pt -69.42 -34.92 64.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.209 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 491' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 501' ' ' LEU . 90.0 t80 -61.65 -47.08 87.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.157 0.503 . . . . 0.0 109.846 172.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -61.38 -35.11 76.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.547 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -87.59 13.98 9.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.512 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.87 24.12 14.37 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 111.121 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.57 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.4 t -76.43 -39.11 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.644 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.616 HD11 HD22 ' B' ' 501' ' ' LEU . 30.9 pt -132.26 158.94 43.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.205 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 3.6 p -94.69 -178.3 4.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.814 0.34 . . . . 0.0 111.792 -176.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.486 ' O ' HG23 ' B' ' 502' ' ' VAL . 41.4 ttp180 -55.67 -55.09 36.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.735 -175.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 499' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -58.67 -39.93 82.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.5 -176.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 6.3 mm-40 -61.61 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.805 0.336 . . . . 0.0 110.385 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 491' ' ' PHE . 0.2 OUTLIER -59.09 -50.58 73.52 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.542 0.687 . . . . 0.0 109.747 177.877 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 498' ' ' ARG . 58.0 t -60.64 -35.19 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.704 -1.135 . . . . 0.0 111.097 -177.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.621 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 75.9 mt-30 -79.15 -35.8 41.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.675 -178.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.554 HD21 HD11 ' A' ' 153' ' ' LEU . 67.3 mt -68.19 -38.62 82.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.876 0.37 . . . . 0.0 111.44 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.559 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.6 p -86.26 1.43 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.126 0.489 . . . . 0.0 110.877 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.563 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.2 t -60.54 -47.74 95.38 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.813 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.572 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 32.4 Cg_exo -62.24 -7.08 9.37 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.285 1.99 . . . . 0.0 112.715 175.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -104.15 -58.25 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.833 0.349 . . . . 0.0 110.766 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.559 ' HG ' HG22 ' B' ' 505' ' ' VAL . 80.9 mt -88.49 -2.06 58.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.497 -174.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -65.83 -18.05 65.88 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.08 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 2.5 mptp? -92.21 -2.94 56.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.252 0.549 . . . . 0.0 109.645 178.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -127.55 85.25 61.28 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.853 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.16 -44.51 45.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.174 2.583 . . . . 0.0 112.927 -175.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.63 -46.27 89.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.024 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.536 ' HG ' ' CE1' ' B' ' 467' ' ' PHE . 2.2 tp -69.86 -40.73 75.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.736 -175.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.458 ' CE2' ' HD2' ' B' ' 520' ' ' LYS . 49.6 t80 -66.4 -41.76 88.86 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.2 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -63.23 -45.06 93.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.41 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.463 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 36.7 t90 -56.65 -48.6 77.21 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.145 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.604 ' CZ ' HD12 ' B' ' 501' ' ' LEU . 8.8 t80 -58.43 -47.29 84.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.856 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 50.6 mtpt -61.11 -42.49 98.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.758 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -65.56 -43.84 88.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.257 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.35 -45.51 83.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.89 0.376 . . . . 0.0 110.548 -178.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 89.4 mt -71.15 -26.91 63.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.608 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.78 36.6 8.42 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.668 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -90.84 115.98 28.32 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -133.96 17.69 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -84.78 22.08 1.42 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.874 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.488 -178.616 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -74.79 -41.6 59.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -125.23 -73.34 0.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 62.28 -148.19 48.81 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.101 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 8.2 t -79.5 123.15 27.29 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -149.75 -70.94 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.158 -177.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -173.42 175.01 3.15 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 17.8 t70 69.22 110.71 0.05 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.439 0.638 . . . . 0.0 111.769 178.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLY . . . . . 0.719 ' HA3' ' HA ' ' A' ' 139' ' ' PRO . . . -132.86 162.52 24.19 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.682 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLY . . . . . 0.41 ' O ' ' HB3' ' A' ' 137' ' ' ASP . . . -83.47 107.05 2.88 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.688 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 136' ' ' GLY . 14.0 t70 70.59 -65.67 0.32 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.369 0.668 . . . . 0.0 110.878 -175.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.0 m -109.98 103.74 54.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.992 178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.719 ' HA ' ' HA3' ' A' ' 135' ' ' GLY . 37.7 Cg_endo -67.56 -38.64 13.92 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.584 2.19 . . . . 0.0 112.051 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 46.3 t -77.47 117.69 22.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.166 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -86.91 149.22 24.96 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.987 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.1 t70 68.51 104.11 0.05 Allowed 'General case' 0 N--CA 1.465 0.308 0 O-C-N 123.932 0.77 . . . . 0.0 110.241 -175.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 1.2 pp -82.44 139.33 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.484 0.659 . . . . 0.0 112.545 -173.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.527 ' O ' ' HB2' ' B' ' 477' ' ' SER . 8.4 t70 -89.8 -54.98 3.81 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.366 167.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 39.3 m -157.81 106.88 1.78 Allowed Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.403 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.434 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 10.7 Cg_exo -70.19 162.34 42.66 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.392 2.061 . . . . 0.0 111.045 176.14 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -114.67 146.58 40.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.028 0.442 . . . . 0.0 111.422 -175.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.65 124.48 62.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.71 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -88.6 135.37 33.53 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.214 175.291 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.51 HD13 HG12 ' A' ' 182' ' ' VAL . 94.5 mt -114.71 0.63 13.93 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.54 ' HA ' HG21 ' A' ' 179' ' ' VAL . 31.1 t80 -75.78 -25.41 56.41 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -66.67 -24.71 66.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.742 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.596 HD21 HD21 ' B' ' 504' ' ' LEU . 26.0 mt -62.48 147.95 47.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.852 0.358 . . . . 0.0 110.668 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 154' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 158' ' ' LEU . 17.9 mp0 -62.52 145.33 54.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.56 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 178' ' ' LEU . 5.6 p -57.32 -35.58 49.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.588 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -73.26 -33.82 65.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.898 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 34.6 m -65.02 -40.0 94.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.161 0.505 . . . . 0.0 110.07 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 153' ' ' LEU . 29.2 mt -65.71 -38.95 90.63 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.487 0.66 . . . . 0.0 110.02 175.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -62.68 -39.39 93.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.225 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 6.6 ttm180 -68.03 -44.32 76.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.929 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.674 ' HA ' HG13 ' B' ' 495' ' ' VAL . 65.8 t80 -51.77 -57.9 7.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.871 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 158' ' ' LEU . 2.6 ptpp? -68.95 -32.4 71.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.2 -36.65 66.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.967 0.413 . . . . 0.0 110.682 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -76.74 -31.37 57.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.702 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -92.97 -4.46 52.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.767 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 60.71 60.31 1.94 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.154 0.502 . . . . 0.0 111.18 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 89.5 mt -91.53 136.22 26.98 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.061 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 25.7 Cg_exo -61.83 125.4 16.5 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.485 2.123 . . . . 0.0 111.861 -178.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.49 ' HB ' HD11 ' A' ' 173' ' ' LEU . 19.5 p -134.0 164.7 26.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.261 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -126.92 144.72 51.25 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.377 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.38 130.84 37.63 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.772 2.315 . . . . 0.0 112.525 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 106.61 36.66 2.57 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.992 -0.623 . . . . 0.0 111.561 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.49 HD11 ' HB ' ' A' ' 169' ' ' THR . 87.2 mt -73.62 167.94 20.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.275 0.559 . . . . 0.0 111.764 -178.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.587 ' HB3' ' HG3' ' A' ' 177' ' ' GLN . 26.2 t-20 -137.82 157.93 45.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.412 -178.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.471 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.6 tptm -46.57 -52.75 12.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 122.704 0.402 . . . . 0.0 111.07 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.74 -42.23 98.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 174' ' ' ASN . 74.3 mt-30 -63.09 -38.01 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.231 0.539 . . . . 0.0 110.345 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.654 HD12 HG23 ' A' ' 155' ' ' VAL . 89.0 mt -64.13 -41.64 97.14 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.113 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.54 HG21 ' HA ' ' A' ' 151' ' ' TYR . 80.8 t -62.49 -41.25 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 O-C-N 123.782 0.676 . . . . 0.0 111.001 177.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.77 -51.19 70.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.597 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.96 -46.62 96.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.97 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.51 HG12 HD13 ' A' ' 150' ' ' LEU . 65.4 t -62.45 -49.16 84.98 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.434 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.85 97.3 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.372 -0.442 . . . . 0.0 112.534 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.78 -44.2 97.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.699 0.285 . . . . 0.0 110.75 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -82.13 -29.81 31.46 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.104 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -58.89 -41.16 86.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.103 0.477 . . . . 0.0 110.498 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -77.52 9.45 3.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.503 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -131.4 14.88 5.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.528 0.204 . . . . 0.0 111.483 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.641 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 66.5 mt -80.73 119.29 75.75 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 120.69 0.281 . . . . 0.0 110.997 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.61 124.52 9.37 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.859 2.373 . . . . 0.0 111.118 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.584 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.2 p -142.44 128.46 17.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.458 0.647 . . . . 0.0 112.068 -173.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -98.66 127.55 44.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.128 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 41.7 tt0 -54.5 -60.45 3.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 122.751 0.42 . . . . 0.0 112.13 -175.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -55.17 -57.3 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.89 -174.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -60.59 -44.21 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.622 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 94.9 m -66.13 -41.43 90.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.795 -176.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 49.2 mt -60.19 -45.7 92.22 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 175.691 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.3 m -61.56 -41.15 96.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.256 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.3 m -62.52 -52.06 64.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.817 178.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.566 ' O ' HG23 ' A' ' 204' ' ' VAL . 71.2 t80 -57.98 -57.78 11.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.002 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.606 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 78.6 mt -54.46 -55.16 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -56.8 -40.27 75.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.092 -175.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.9 m -67.44 -48.86 66.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.482 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 200' ' ' PHE . 11.7 t -69.87 -22.55 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 120.936 0.398 . . . . 0.0 110.619 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 10.5 mmm180 -70.31 -27.31 64.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.208 173.641 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -94.08 -66.04 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.744 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -140.05 130.92 26.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.659 0.742 . . . . 0.0 109.593 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.739 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 59.7 mttp -83.33 57.44 3.99 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.879 -178.023 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 61.26 73.9 0.46 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -101.1 1.99 39.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.839 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 21.2 t -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.678 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -110.94 -59.23 1.99 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.855 -178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 45.6 tp -77.54 116.43 18.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.063 -176.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -109.3 121.71 45.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.995 178.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 64.94 90.4 0.09 Allowed 'General case' 0 N--CA 1.464 0.266 0 O-C-N 124.082 0.864 . . . . 0.0 111.55 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -86.05 125.67 33.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.242 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 24.7 m 58.47 54.3 5.63 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.587 0.554 . . . . 0.0 111.066 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -76.62 -19.43 77.94 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.909 -0.663 . . . . 0.0 111.946 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 30.1 m -63.69 133.2 29.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.993 0.425 . . . . 0.0 110.788 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.81 -0.614 . . . . 0.0 109.841 -178.234 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 N--CA 1.475 0.819 0 CA-C-O 120.732 0.301 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -76.27 -45.08 34.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 110.256 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -101.31 100.25 10.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.708 178.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 24.5 m -84.75 -32.87 23.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.376 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -128.89 157.55 41.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.046 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -134.83 129.3 34.28 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -97.73 -159.4 30.69 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.573 -177.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 9.7 p -80.83 -30.76 12.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.087 0.47 . . . . 0.0 110.477 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 179.91 167.09 36.52 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.913 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.6 t -90.96 -0.1 57.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.69 0.281 . . . . 0.0 110.865 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -59.34 -54.8 42.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.437 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 60.9 m -58.17 -31.53 67.35 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.408 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.5 tt -64.05 -49.69 71.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.683 176.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.496 ' O ' HG23 ' B' ' 471' ' ' VAL . 70.3 t80 -57.05 -56.39 22.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.332 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -62.87 -33.24 74.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -173.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.6 -44.19 82.79 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.068 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.92 -43.44 98.85 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.759 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 467' ' ' PHE . 86.0 t -58.6 -47.67 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 121.038 0.447 . . . . 0.0 110.817 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -39.51 81.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.423 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -76.92 -41.59 42.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.232 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -70.31 -46.02 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.976 -174.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.23 -29.62 67.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.71 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 70.72 -60.43 0.5 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.006 0.816 . . . . 0.0 111.833 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.527 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 17.1 t -67.04 127.94 34.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.996 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.03 -23.05 64.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.709 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -75.08 -40.66 59.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.698 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -67.17 -42.26 84.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.228 176.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.513 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 65.4 t80 -65.81 -32.02 73.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.866 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 34.9 tt0 -64.47 -44.58 90.61 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 175.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -44.81 78.21 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 81.9 t80 -55.43 -44.29 76.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.294 0.569 . . . . 0.0 109.978 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.584 ' HB3' HG21 ' A' ' 191' ' ' VAL . 89.3 mt -69.27 -31.19 69.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.354 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.641 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.1 OUTLIER -60.89 -44.06 97.61 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.041 0.448 . . . . 0.0 109.995 173.083 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.0 m -61.23 -36.79 80.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.199 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 45.6 mt -67.48 -47.6 69.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.463 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 14.3 m -65.19 -41.24 91.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.845 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 486' ' ' ARG . 16.1 pt -70.27 -32.94 52.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.944 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -63.68 -44.08 94.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -66.12 -34.01 77.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.533 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -87.79 21.98 2.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.856 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 63.3 25.24 14.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.025 0.441 . . . . 0.0 111.86 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.674 HG13 ' HA ' ' A' ' 161' ' ' TYR . 75.5 t -88.71 -48.47 14.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.34 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 44.1 pt -116.69 160.02 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.463 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.451 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 33.2 m -96.79 -174.0 2.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.18 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.739 ' HD2' ' HB3' ' A' ' 208' ' ' LYS . 20.5 mtp-105 -64.37 -53.35 50.07 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -176.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.21 -48.8 77.89 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -171.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.565 ' HA ' ' HG2' ' B' ' 503' ' ' GLN . 2.5 pm0 -66.29 -32.8 74.42 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.828 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.587 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -58.81 -44.72 90.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.824 0.345 . . . . 0.0 110.487 176.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.507 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.3 OUTLIER -69.82 -41.49 79.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.671 -178.528 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.565 ' HG2' ' HA ' ' B' ' 500' ' ' GLU . 18.8 pt20 -73.71 -23.33 59.77 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -173.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 153' ' ' LEU . 85.4 mt -66.8 -38.31 86.24 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.954 -0.466 . . . . 0.0 110.905 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.622 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.9 p -89.55 6.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.304 0.573 . . . . 0.0 110.599 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.495 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.5 t -61.14 -46.32 95.99 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.851 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.571 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 48.8 Cg_exo -58.63 -16.37 30.06 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.172 1.915 . . . . 0.0 112.765 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -99.95 -52.76 3.34 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.888 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.736 HD22 HD23 ' B' ' 515' ' ' LEU . 76.8 mt -92.09 0.86 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.634 -175.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.6 -17.17 68.61 Favored Glycine 0 C--O 1.23 -0.156 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.513 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.571 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 3.2 mptp? -90.94 -3.54 57.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.388 0.614 . . . . 0.0 109.46 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 43.4 m-85 -129.0 84.79 61.99 Favored Pre-proline 0 N--CA 1.448 -0.567 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.968 -174.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.95 -49.78 16.4 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.42 2.747 . . . . 0.0 112.893 -173.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.98 -34.03 75.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.385 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.736 HD23 HD22 ' B' ' 509' ' ' LEU . 9.8 tp -78.12 -43.78 27.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.377 -173.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.61 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 52.4 t80 -68.13 -37.31 80.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.091 178.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.42 -34.04 75.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.21 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -59.41 -48.47 81.5 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 175.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.529 ' O ' HD13 ' B' ' 523' ' ' LEU . 3.2 t80 -58.04 -44.03 87.15 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.185 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.61 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 88.7 mttt -60.16 -44.07 95.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.073 175.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -63.87 -39.51 94.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.508 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -70.55 -31.58 68.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.44 0.638 . . . . 0.0 110.045 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.587 HD21 HD23 ' B' ' 501' ' ' LEU . 10.6 mp -88.1 1.19 54.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.924 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 59.25 37.31 91.65 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.025 -178.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 525' ' ' TYR . . . . . 0.4 ' HD2' ' HG2' ' B' ' 520' ' ' LYS . 19.2 t80 -101.39 114.17 27.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 110.944 -175.112 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.0 mttp -98.91 131.24 45.14 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.623 175.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.32 88.4 2.21 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 13.2 m . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.522 -0.752 . . . . 0.0 110.378 -178.179 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.33 0.11 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.4 t30 66.71 99.19 0.05 OUTLIER 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.263 0.554 . . . . 0.0 111.489 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 65.41 25.93 11.96 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.698 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -163.33 -172.15 30.46 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.314 -0.946 . . . . 0.0 112.717 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 39.7 t -139.31 120.09 14.3 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -121.74 160.52 24.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.92 138.32 45.44 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.875 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -107.46 18.22 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.237 0.542 . . . . 0.0 110.604 -175.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 88.0 164.41 40.2 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.835 -178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 151.7 -154.82 25.79 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.848 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -141.21 133.4 27.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 10.3 p -61.53 121.88 67.06 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 121.066 0.46 . . . . 0.0 111.474 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.68 175.09 9.34 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.795 2.33 . . . . 0.0 112.132 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.18 141.03 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 175.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -100.14 66.97 1.36 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.573 0.701 . . . . 0.0 110.813 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -90.98 -16.53 27.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.153 174.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.544 HG21 ' HG3' ' A' ' 146' ' ' PRO . 15.0 mt 66.03 132.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.501 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' B' ' 477' ' ' SER . 32.3 t70 -93.27 -56.0 3.11 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.532 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.7 m -161.39 111.13 1.23 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.473 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.544 ' HG3' HG21 ' A' ' 143' ' ' ILE . 15.2 Cg_exo -68.59 142.98 55.14 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.823 2.349 . . . . 0.0 111.612 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -100.73 141.32 33.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.6 p -84.44 129.39 37.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 110.561 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.31 100.63 9.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.06 3.29 53.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.2 0.524 . . . . 0.0 110.668 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -76.6 -27.63 55.84 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.619 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.2 OUTLIER -51.82 -41.5 61.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.824 171.51 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.582 HD21 HD11 ' B' ' 504' ' ' LEU . 64.5 mt -61.01 128.19 35.23 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.837 -178.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -62.36 160.86 12.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.521 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.7 -44.18 69.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.122 0.486 . . . . 0.0 110.362 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.59 -37.97 88.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.057 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.408 HG21 HD22 ' A' ' 153' ' ' LEU . 10.6 m -64.35 -45.2 88.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.987 0.422 . . . . 0.0 110.556 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 71.8 mt -59.86 -46.84 88.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.584 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -63.84 -34.94 79.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.84 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' B' ' 494' ' ' GLU . 13.7 ttm180 -66.1 -46.47 77.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.561 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.44 ' HA ' HG13 ' B' ' 495' ' ' VAL . 83.7 t80 -52.52 -48.02 66.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.365 173.534 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.588 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 6.5 mtpm? -65.46 -34.78 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.427 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -75.27 -40.54 58.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.762 0.315 . . . . 0.0 111.032 -176.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -74.48 -43.71 54.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.804 0.335 . . . . 0.0 111.327 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.439 ' CE1' HG22 ' B' ' 490' ' ' ILE . 39.2 m-85 -85.48 0.24 52.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.353 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 57.39 73.12 0.48 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.433 176.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.588 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 76.0 mt -113.69 135.23 21.95 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.856 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.16 157.4 25.63 Favored 'Trans proline' 0 C--O 1.238 0.476 0 C-N-CA 123.243 2.629 . . . . 0.0 112.381 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.544 ' HB ' HD11 ' A' ' 173' ' ' LEU . 13.8 p -139.5 106.61 5.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.43 -178.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 170' ' ' ARG . 7.9 ptp180 -64.35 150.31 93.23 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.182 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.74 128.07 21.22 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.541 2.161 . . . . 0.0 111.812 177.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 100.41 57.25 0.89 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.775 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.544 HD11 ' HB ' ' A' ' 169' ' ' THR . 83.3 mt -83.78 142.71 30.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.297 0.57 . . . . 0.0 111.748 -179.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.761 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 14.0 m120 -138.54 179.75 6.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.033 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 179' ' ' VAL . 27.7 tptp -57.4 -53.45 58.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.881 0.372 . . . . 0.0 110.798 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.89 -27.84 67.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.295 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.761 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 31.5 mm-40 -67.77 -44.76 76.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.42 0.629 . . . . 0.0 110.154 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 91.2 mt -64.13 -42.71 96.72 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.837 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 175' ' ' LYS . 67.9 t -60.66 -42.41 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.544 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 177' ' ' GLN . 8.0 pt-20 -67.94 -40.85 83.23 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.259 -177.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 180' ' ' GLU . 60.0 mt -67.46 -48.71 76.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 120.916 0.389 . . . . 0.0 110.257 176.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 55.0 t -58.21 -49.05 83.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.706 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.39 96.28 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.546 -177.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 46.7 t -59.05 -46.41 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.969 0.414 . . . . 0.0 110.619 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.77 -26.28 31.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.231 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.494 ' HE1' HD13 ' B' ' 490' ' ' ILE . 35.6 t80 -66.33 -34.85 78.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.176 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -78.33 10.23 3.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.611 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.9 p -136.09 38.82 2.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.948 0.404 . . . . 0.0 111.332 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.89 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 73.8 mt -102.39 115.75 63.98 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.436 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.86 113.22 2.92 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 122.669 2.246 . . . . 0.0 111.918 177.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.603 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.1 p -115.75 154.21 17.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.761 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -118.62 112.89 20.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.561 ' HA ' HD22 ' B' ' 485' ' ' LEU . 32.6 tt0 -51.3 -65.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -58.4 -48.9 79.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.571 0.224 . . . . 0.0 111.356 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.46 -45.76 78.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.837 -174.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 196' ' ' THR . . . . . 0.52 ' HB ' HD23 ' B' ' 485' ' ' LEU . 85.3 m -68.7 -37.37 79.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.848 -0.16 . . . . 0.0 110.903 -176.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 53.3 mt -60.73 -47.34 86.75 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 40.7 m -57.91 -47.2 83.52 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.644 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.4 -48.24 82.4 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.57 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.54 ' CG ' HD22 ' B' ' 488' ' ' LEU . 68.8 t80 -64.63 -47.95 76.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.285 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' B' ' 468' ' ' PHE . 78.8 mt -57.44 -44.62 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.021 -177.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -71.07 -35.0 71.73 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.185 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 73.8 m -60.89 -50.23 74.27 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.733 0.301 . . . . 0.0 110.866 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 200' ' ' PHE . 20.4 t -71.48 -33.51 49.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.064 -177.025 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -69.15 -27.04 65.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.456 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.74 -63.4 1.08 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -178.09 177.95 0.97 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 11.0 mptt -101.7 118.72 37.51 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.749 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.39 114.61 3.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.522 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -161.07 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.739 -177.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 49.5 m 61.96 -176.15 0.13 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.244 0.545 . . . . 0.0 112.147 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -158.15 -45.43 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.324 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 67.3 tp -98.91 105.7 17.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.885 0.374 . . . . 0.0 110.551 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -120.65 11.74 11.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.627 0.727 . . . . 0.0 109.204 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -103.8 13.99 31.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.833 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -91.83 -47.94 7.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.022 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.8 m -82.05 84.83 6.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.731 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -90.58 -88.39 1.35 Allowed Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.231 -0.748 . . . . 0.0 111.231 176.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 14.7 p -94.49 -21.49 5.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.537 0.684 . . . . 0.0 109.343 175.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.976 176.521 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.835 0.35 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -94.9 99.83 11.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.03 0.443 . . . . 0.0 110.665 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -120.06 -26.15 5.61 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.422 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 35.1 t -82.49 147.39 28.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.605 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -64.26 -36.26 83.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.226 0.536 . . . . 0.0 109.763 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -144.68 119.8 10.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.048 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -79.34 -171.68 41.62 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.43 -175.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 461' ' ' VAL . . . . . 0.683 HG13 ' HB2' ' B' ' 464' ' ' GLU . 59.5 t -90.54 121.04 40.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -133.27 -72.54 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.115 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 463' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.9 p -72.79 -25.3 61.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.695 0.283 . . . . 0.0 111.075 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.683 ' HB2' HG13 ' B' ' 461' ' ' VAL . 50.9 mp0 -62.93 -51.21 67.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.909 177.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 17.0 t -63.93 -33.32 75.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.95 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 42.7 tp -58.17 -53.9 53.07 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.169 175.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.451 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.3 t80 -54.03 -55.07 30.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.925 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.473 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.6 m-85 -61.36 -39.5 90.85 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -174.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.8 -39.93 95.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.82 0.343 . . . . 0.0 110.337 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 470' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.3 mttt -63.01 -46.25 88.53 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.184 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 467' ' ' PHE . 85.5 t -57.09 -44.47 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.139 0.495 . . . . 0.0 110.521 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -58.43 -42.33 87.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.967 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -80.28 -44.86 18.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.035 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.511 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -61.88 -42.45 99.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 475' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' B' ' 477' ' ' SER . 10.6 mp -71.57 -37.95 71.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.217 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 ttp85 70.48 -36.78 0.37 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.976 0.91 . . . . 0.0 111.935 177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.1 t -80.51 121.6 25.98 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.901 0.382 . . . . 0.0 110.875 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.95 72.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.706 177.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -63.34 -42.0 98.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.147 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.06 -40.98 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.243 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.548 ' O ' HD12 ' B' ' 485' ' ' LEU . 72.9 t80 -62.51 -45.01 94.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.395 0.617 . . . . 0.0 109.481 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 38.9 tt0 -57.29 -43.94 83.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.038 176.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -56.71 -43.92 81.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.801 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -54.77 -51.44 65.73 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.603 ' HB3' HG21 ' A' ' 191' ' ' VAL . 1.5 mp -66.01 -26.25 67.45 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.89 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.0 mtt85 -68.0 -37.35 81.36 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.801 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 47.6 m -63.08 -32.01 73.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.222 0.534 . . . . 0.0 109.741 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.54 HD22 ' CG ' ' A' ' 200' ' ' PHE . 72.0 mt -68.18 -45.71 72.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.356 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 19.4 m -66.01 -40.89 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.555 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.494 HD13 ' HE1' ' A' ' 186' ' ' PHE . 17.3 pt -69.66 -30.82 46.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -66.32 -42.15 88.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 110.006 174.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.6 -35.58 81.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.561 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -89.62 26.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.019 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 494' ' ' GLU . . . . . 0.549 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 12.4 pt-20 46.14 32.41 1.43 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.29 1.036 . . . . 0.0 112.649 177.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.478 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 63.8 t -81.76 -42.55 19.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.4 pt -116.13 175.87 2.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 16.3 m -115.15 174.95 5.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.065 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.46 ' O ' HG23 ' B' ' 502' ' ' VAL . 60.8 ttp180 -57.51 -52.39 65.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.506 0.193 . . . . 0.0 110.675 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.5 -46.61 83.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.834 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.8 mm-40 -56.02 -50.44 70.91 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.464 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.518 HD23 HD21 ' B' ' 523' ' ' LEU . 64.3 tp -59.79 -49.0 79.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.405 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.536 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 93.1 t -59.89 -38.52 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.619 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 16.2 mm100 -72.25 -38.91 68.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.413 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.582 HD11 HD21 ' A' ' 153' ' ' LEU . 65.6 mt -58.64 -37.55 76.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.475 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.1 p -91.22 6.01 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.056 0.455 . . . . 0.0 111.4 -175.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.606 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 93.4 p -63.07 -42.17 75.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.606 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 25.8 Cg_exo -65.96 -10.49 27.15 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.88 1.72 . . . . 0.0 112.367 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -99.16 -57.2 2.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.475 ' HG ' HG22 ' B' ' 505' ' ' VAL . 57.3 mt -92.49 3.04 56.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.811 -175.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.59 -22.58 71.67 Favored Glycine 0 N--CA 1.454 -0.12 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.966 -177.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.437 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.7 mptp? -87.37 -2.42 58.6 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.511 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 46.3 m-85 -127.04 90.81 48.44 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.923 -176.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.45 -47.21 20.2 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.35 2.7 . . . . 0.0 113.282 -172.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 514' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' B' ' 514' ' ' GLU . 0.0 OUTLIER -72.51 -32.72 66.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.898 0.38 . . . . 0.0 110.918 -176.531 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.473 HD23 HD22 ' B' ' 509' ' ' LEU . 15.8 tp -71.31 -43.74 66.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.072 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.525 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 28.5 t80 -66.61 -34.97 79.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.995 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -63.87 -39.85 95.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.648 175.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -58.1 -49.06 78.25 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.536 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 37.3 t80 -56.67 -45.86 81.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.763 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.525 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.0 mttt -58.87 -39.98 83.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.721 0.296 . . . . 0.0 111.471 178.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -71.22 -38.72 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.304 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -64.61 -45.34 87.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.849 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.518 HD21 HD23 ' B' ' 501' ' ' LEU . 5.6 mp -83.28 -2.72 56.34 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 64.51 52.32 44.28 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.772 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -65.87 93.3 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -87.07 116.57 25.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.707 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -95.55 20.39 9.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 -176.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.01 -179.765 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 46.6 m . . . . . 0 N--CA 1.477 0.912 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -116.66 -0.6 12.33 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.64 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -93.42 -9.27 39.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.283 0.563 . . . . 0.0 110.376 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 152.55 -109.95 0.43 Allowed Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.433 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 21.4 m 64.56 -174.35 0.17 Allowed 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.518 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -147.06 172.58 13.52 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.96 -11.3 42.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.0 0.429 . . . . 0.0 111.515 -171.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -100.52 -54.78 2.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.853 0.359 . . . . 0.0 111.053 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.79 62.96 0.1 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.051 -0.595 . . . . 0.0 111.673 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -80.18 -60.49 2.38 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.094 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 34.9 t70 62.4 98.06 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.111 0.565 . . . . 0.0 111.007 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.9 m 70.81 92.97 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.083 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.86 -32.18 18.64 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.708 2.272 . . . . 0.0 111.852 177.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.4 m -110.2 159.94 9.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.658 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -107.14 -162.29 0.83 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.845 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 63.89 46.3 3.95 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.375 0.607 . . . . 0.0 109.493 -174.591 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.24 136.76 22.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.945 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' B' ' 477' ' ' SER . 19.6 p-10 -80.16 -53.23 6.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.35 -0.386 . . . . 0.0 109.989 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 90.3 m -166.14 109.26 0.72 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.965 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 9.4 Cg_exo -71.35 158.72 53.65 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.252 1.968 . . . . 0.0 110.791 173.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -108.82 145.27 35.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.029 0.443 . . . . 0.0 111.339 -175.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.74 135.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.774 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -105.62 131.99 52.31 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.424 HD13 HG12 ' A' ' 182' ' ' VAL . 96.2 mt -110.28 5.9 22.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.145 0.497 . . . . 0.0 110.471 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -84.99 -24.19 28.36 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 -28.3 69.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.437 172.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.503 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -63.75 158.16 22.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.104 0.478 . . . . 0.0 110.989 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -78.78 148.95 32.76 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.454 177.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.528 HG13 ' CD1' ' A' ' 178' ' ' LEU . 85.6 t -53.96 -45.29 63.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 CA-C-O 121.198 0.523 . . . . 0.0 110.317 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -60.3 -36.6 78.26 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.631 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 26.7 m -68.23 -43.75 77.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.098 0.475 . . . . 0.0 110.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.401 HD22 HG21 ' A' ' 182' ' ' VAL . 88.0 mt -65.03 -38.54 91.22 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.352 0.596 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 79.9 mtp180 -70.72 -30.59 67.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.309 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.496 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 42.2 ttm105 -70.46 -42.76 71.05 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.651 ' HA ' HG13 ' B' ' 495' ' ' VAL . 52.2 t80 -48.86 -58.2 5.2 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.071 173.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 6.4 ptpp? -67.97 -27.37 66.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.71 -176.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 163' ' ' ARG . 38.7 ttm180 -67.81 -51.62 46.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 177.308 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -67.31 -37.2 82.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.011 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -88.85 0.15 56.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt 59.69 74.94 0.42 Allowed 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.669 0.606 . . . . 0.0 111.984 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.614 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 82.5 mt -117.6 110.63 40.38 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.96 176.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.08 127.38 16.7 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.672 2.248 . . . . 0.0 112.129 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.547 HG22 HD13 ' A' ' 181' ' ' ILE . 30.7 p -124.35 163.8 20.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.987 0.422 . . . . 0.0 111.9 -175.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -92.35 151.93 41.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.066 179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.54 145.39 91.84 Favored 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.512 2.141 . . . . 0.0 112.172 178.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 78.94 48.34 7.08 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.223 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.545 HD11 ' HB ' ' A' ' 169' ' ' THR . 97.9 mt -74.75 150.08 39.53 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.93 0.395 . . . . 0.0 111.061 178.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.446 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 16.2 t-20 -120.37 167.24 12.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.502 ' HD3' HG22 ' A' ' 155' ' ' VAL . 21.7 tptm -54.38 -52.49 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.555 0.342 . . . . 0.0 111.29 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 176' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.48 -36.81 76.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.349 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 19.9 mm-40 -64.42 -44.01 92.54 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.15 0.5 . . . . 0.0 110.167 -179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.528 ' CD1' HG13 ' A' ' 155' ' ' VAL . 85.7 mt -62.38 -41.17 98.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.778 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 71.2 t -62.28 -43.98 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 123.622 0.576 . . . . 0.0 111.114 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 48.4 mt-10 -61.05 -44.74 96.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.789 0.328 . . . . 0.0 110.771 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.547 HD13 HG22 ' A' ' 169' ' ' THR . 72.5 mt -63.58 -50.62 77.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.581 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.424 HG12 HD13 ' A' ' 150' ' ' LEU . 69.1 t -61.03 -46.18 97.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.557 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.21 -40.61 99.28 Favored Glycine 0 N--CA 1.448 -0.546 0 O-C-N 123.368 0.417 . . . . 0.0 112.618 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -60.02 -43.31 95.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.358 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -78.87 -28.83 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.597 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.1 -29.98 70.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.537 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -80.75 0.41 34.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.11 176.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.8 t -126.1 24.81 6.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.892 0.377 . . . . 0.0 110.74 -175.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.848 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.4 mt -90.17 117.47 68.07 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.885 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.67 118.79 5.6 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.542 2.161 . . . . 0.0 111.157 174.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.431 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -133.42 154.93 39.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.486 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -132.11 128.25 37.73 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.519 ' HG3' ' HE2' ' B' ' 481' ' ' TYR . 34.7 tt0 -51.98 -63.83 1.01 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.94 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -57.08 -53.74 54.69 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.038 0.447 . . . . 0.0 112.059 -174.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -65.61 -46.6 78.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.911 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.5 m -67.03 -36.7 82.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.375 -176.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 45.0 mt -60.64 -45.86 92.51 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 61.1 m -56.97 -45.54 82.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.741 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 62.5 m -60.08 -54.52 45.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.085 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.549 ' CD1' HD22 ' B' ' 488' ' ' LEU . 71.9 t80 -57.27 -48.29 79.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.278 -177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.487 ' O ' ' HB2' ' A' ' 205' ' ' ARG . 87.8 mt -61.0 -47.23 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.488 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -65.29 -36.45 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.188 -175.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -69.53 -61.22 1.87 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.853 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.22 -29.12 46.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -170.606 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 201' ' ' ILE . 11.7 mtp180 -79.63 -3.59 47.86 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -125.32 -65.64 1.0 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.417 . . . . 0.0 110.804 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -131.51 104.29 6.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.496 0.665 . . . . 0.0 110.178 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.7 89.57 6.76 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.519 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 63.1 t30 67.1 86.22 0.13 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.524 -172.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.879 ' HD2' ' H ' ' A' ' 210' ' ' LYS . 0.0 OUTLIER -45.76 112.99 0.53 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.183 -175.865 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 24.7 m -149.73 -178.73 6.62 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.393 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -70.34 -34.57 72.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.638 0.256 . . . . 0.0 110.453 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 57.8 tp 68.51 -85.01 0.03 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.169 177.159 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt 179.44 117.51 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -178.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -108.86 135.02 50.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.707 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -105.81 87.35 2.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.318 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 31.4 m -113.64 158.04 21.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.212 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 112.03 -81.74 0.29 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.66 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 35.4 m -125.44 156.51 34.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.86 0.362 . . . . 0.0 110.396 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.668 -179.428 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.8 -14.31 48.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.041 176.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.21 111.82 21.38 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.895 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 17.8 m -94.22 -26.54 16.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.097 179.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -106.85 144.31 33.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.491 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 58.8 m170 60.41 40.2 17.61 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.184 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -76.79 48.5 2.66 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.047 -0.596 . . . . 0.0 112.521 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 17.3 m -126.08 22.63 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.197 0.522 . . . . 0.0 110.694 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -75.53 1.83 55.81 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.443 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 10.0 p -69.49 -25.69 64.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.632 0.253 . . . . 0.0 111.477 -179.084 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.477 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 0.8 OUTLIER -63.14 -47.46 82.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.096 176.341 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.6 m -60.24 -39.55 87.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.259 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 44.9 tp -59.08 -51.74 68.76 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.481 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.6 t80 -53.89 -56.96 12.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.739 178.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -64.37 -36.58 84.61 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -173.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.45 -41.92 88.38 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.586 -0.446 . . . . 0.0 109.965 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 470' ' ' LYS . . . . . 0.401 ' HD2' HD13 ' B' ' 515' ' ' LEU . 38.9 ttmt -62.38 -43.95 97.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.067 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.648 HG13 HD21 ' B' ' 509' ' ' LEU . 86.7 t -59.96 -51.91 67.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.16 0.505 . . . . 0.0 110.782 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -58.7 -34.1 70.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.202 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 473' ' ' LYS . . . . . 0.448 ' HB2' ' HE3' ' B' ' 473' ' ' LYS . 36.9 ttmt -85.19 -31.93 22.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.511 -176.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.89 -39.6 30.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.644 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 475' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' B' ' 477' ' ' SER . 66.0 mt -62.91 -35.65 80.77 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.934 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 476' ' ' ARG . 35.4 ttt180 71.81 -28.58 0.19 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.818 0.699 . . . . 0.0 111.836 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.487 ' HB3' ' O ' ' A' ' 144' ' ' ASP . 1.2 p -96.09 120.39 36.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.058 -177.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.72 99.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -60.51 -35.16 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.084 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.51 -36.8 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 0.0 110.734 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.519 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 44.0 t80 -71.69 -34.57 69.76 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 42.6 tt0 -62.62 -43.03 99.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.709 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -53.67 -48.58 69.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.705 174.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.447 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 83.9 t80 -55.11 -48.73 73.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.525 176.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 95.3 mt -64.53 -32.21 73.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.644 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.848 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.6 mtt180 -68.89 -38.22 79.51 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.483 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.3 -35.49 75.71 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.013 0.435 . . . . 0.0 109.931 172.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.549 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -65.57 -52.19 54.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.067 179.067 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.529 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -61.81 -39.63 84.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.1 pt -69.83 -31.04 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.652 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -67.29 -38.22 84.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 109.97 171.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -72.79 -5.2 36.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.459 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -115.14 13.39 16.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.154 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 59.29 29.33 18.87 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.472 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.651 HG13 ' HA ' ' A' ' 161' ' ' TYR . 71.4 t -80.59 -51.03 16.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.1 0.476 . . . . 0.0 110.333 178.162 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.5 pt -108.51 167.15 4.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.15 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 27.0 t -101.34 177.75 4.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.949 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.568 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 52.5 ttp180 -59.01 -59.46 5.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.179 0.514 . . . . 0.0 110.685 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 499' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -57.35 -40.98 79.21 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.565 -179.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -55.45 -42.81 74.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.103 0.477 . . . . 0.0 110.213 177.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 10.5 tt -64.84 -45.8 84.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.33 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.533 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.1 OUTLIER -64.19 -32.51 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.516 -179.239 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 91.0 mt-30 -68.12 -43.13 79.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.145 178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.503 HD21 HD21 ' A' ' 153' ' ' LEU . 49.3 mt -58.72 -43.51 90.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.106 -177.536 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.537 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -91.58 7.91 4.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.15 0.5 . . . . 0.0 111.038 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.578 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 20.6 t -59.5 -49.49 92.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.927 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 47.3 Cg_exo -59.68 -17.17 40.94 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.256 1.971 . . . . 0.0 112.898 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -95.9 -57.32 2.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.351 -175.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.663 HD22 HD23 ' B' ' 515' ' ' LEU . 53.2 mt -99.26 -9.4 23.68 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -173.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.16 -23.07 71.27 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.527 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.518 ' HZ3' ' HB3' ' B' ' 511' ' ' LYS . 0.8 OUTLIER -78.78 -5.1 52.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.667 178.276 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.403 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 65.9 m-85 -122.12 92.46 48.87 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.783 177.269 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 513' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 7.7 Cg_endo -49.64 -48.0 20.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.606 2.871 . . . . 0.0 113.268 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.84 -34.41 77.87 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.088 0.471 . . . . 0.0 111.095 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.663 HD23 HD22 ' B' ' 509' ' ' LEU . 12.9 tp -78.44 -43.8 26.31 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.016 -174.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.533 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 11.8 t80 -69.75 -32.27 70.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.853 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 517' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' B' ' 520' ' ' LYS . 25.5 t-20 -66.33 -37.68 85.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.309 175.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.477 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 27.2 t90 -58.02 -46.98 84.41 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.3 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -38.5 87.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.93 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 516' ' ' PHE . 34.0 mmtp -53.27 -50.52 64.67 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.335 0.588 . . . . 0.0 110.168 174.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.54 -36.27 78.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.86 -175.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -72.78 -39.32 66.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.543 -174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.568 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 10.6 mp -81.53 -19.58 41.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.934 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 74.08 28.22 64.83 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.829 -0.908 . . . . 0.0 110.829 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -82.31 90.07 6.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.171 0.51 . . . . 0.0 110.284 -175.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -79.7 97.38 6.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.29 11.64 36.52 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 47.1 m . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.651 -179.433 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.803 0.335 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -113.82 149.46 34.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.198 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -148.66 159.26 44.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.277 177.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 104.69 -14.95 49.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.686 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.8 m -64.1 112.34 2.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.117 0.484 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -97.84 -25.38 15.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.498 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -94.49 142.78 27.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.356 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.44 63.27 2.13 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.015 0.822 . . . . 0.0 110.761 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -92.68 44.55 2.56 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.967 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -108.56 23.86 23.44 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.668 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.19 104.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.257 0.551 . . . . 0.0 110.618 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.3 m -133.25 101.84 13.31 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.174 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.21 -67.27 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.981 2.454 . . . . 0.0 112.126 178.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 140' ' ' VAL . 10.8 t 64.26 22.64 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.997 0.903 . . . . 0.0 110.3 178.362 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.532 ' HG3' ' HA ' ' B' ' 474' ' ' ALA . 78.9 mm-40 -110.95 113.79 26.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.736 178.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -79.19 -8.93 59.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.551 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.558 HG21 ' HG3' ' A' ' 146' ' ' PRO . 16.7 mt -58.64 134.76 23.49 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.231 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.503 ' O ' ' HB2' ' B' ' 477' ' ' SER . 26.8 t70 -90.91 -57.31 2.86 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.873 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.2 m -165.61 104.58 0.74 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.773 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.558 ' HG3' HG21 ' A' ' 143' ' ' ILE . 11.4 Cg_exo -69.68 155.18 66.88 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.711 2.274 . . . . 0.0 111.686 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -107.59 163.91 12.67 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.718 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.8 p -119.85 121.37 65.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.205 0.526 . . . . 0.0 110.819 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -74.2 118.61 17.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.073 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 62.5 mt -106.72 -6.9 17.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.96 0.41 . . . . 0.0 110.841 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.491 ' HA ' HG21 ' A' ' 179' ' ' VAL . 1.9 t80 -75.21 -14.29 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.393 0.615 . . . . 0.0 109.345 176.39 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.27 -24.64 59.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.9 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.696 HD21 HD21 ' B' ' 504' ' ' LEU . 29.7 mt -68.58 160.25 30.38 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.26 0.552 . . . . 0.0 111.42 -173.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -78.12 156.24 30.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.094 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.46 HG13 ' CD1' ' A' ' 178' ' ' LEU . 50.2 t -58.92 -44.27 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -56.97 -44.54 82.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.671 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.722 HG21 ' HG2' ' B' ' 500' ' ' GLU . 35.8 m -62.93 -48.38 79.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.112 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 95.5 mt -63.28 -44.61 94.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 50.5 mtp180 -65.18 -35.88 82.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.615 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -68.14 -43.82 77.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.612 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -53.26 -50.0 65.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.074 0.464 . . . . 0.0 110.302 174.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.566 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 59.7 mtpt -67.83 -29.02 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.615 -177.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.416 ' O ' ' HD3' ' A' ' 166' ' ' LYS . 44.6 ttm180 -79.72 -43.64 22.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.629 0.252 . . . . 0.0 111.024 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -69.15 -42.66 75.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.737 0.304 . . . . 0.0 110.631 -177.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -84.28 -1.31 55.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.53 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 163' ' ' ARG . 71.7 mmtt 58.35 66.74 1.04 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.464 178.29 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.523 HD13 HG22 ' A' ' 181' ' ' ILE . 94.6 mt -101.18 137.31 19.66 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.499 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.34 139.63 78.23 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.825 2.35 . . . . 0.0 111.953 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 37.6 p -131.65 147.27 52.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 67.4 mtt180 -114.37 145.56 34.0 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.31 129.04 33.07 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.894 2.396 . . . . 0.0 111.724 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 105.36 48.72 1.03 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.307 -176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 88.0 mt -83.16 144.5 29.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.362 0.601 . . . . 0.0 111.183 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.631 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 17.8 m120 -137.14 176.35 8.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.015 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -55.84 -48.73 74.97 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.386 0.429 . . . . 0.0 110.698 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.11 93.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.248 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.631 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 27.9 mm-40 -60.76 -40.42 92.43 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.454 0.645 . . . . 0.0 110.644 -178.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 81.7 mt -63.61 -51.88 63.33 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.745 177.432 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.491 HG21 ' HA ' ' A' ' 151' ' ' TYR . 96.7 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 123.622 0.576 . . . . 0.0 111.695 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.52 -49.18 77.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.465 -178.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.566 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 65.8 mt -70.6 -42.88 78.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 -179.311 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 178' ' ' LEU . 56.0 t -59.26 -49.38 83.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.389 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.426 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.68 -37.54 94.51 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.424 -0.417 . . . . 0.0 112.661 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.9 t -57.9 -43.05 85.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.912 0.387 . . . . 0.0 110.586 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -86.65 -27.59 23.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.832 0.348 . . . . 0.0 111.17 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.471 ' HE1' HD13 ' B' ' 490' ' ' ILE . 50.3 t80 -61.77 -42.73 99.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 -176.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -78.19 17.94 0.57 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 34.9 p -140.59 19.72 2.36 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.457 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.985 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 81.6 mt -78.7 124.03 85.25 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.96 140.55 42.18 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.252 1.968 . . . . 0.0 110.907 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.95 155.78 6.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.919 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -125.32 115.17 19.92 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.3 tt0 -47.78 -64.76 0.7 Allowed 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -172.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -64.7 -45.84 84.91 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -173.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.24 -41.54 89.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.769 0.319 . . . . 0.0 110.92 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.5 m -66.13 -40.16 90.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.917 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 50.0 mt -58.82 -46.68 87.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 55.8 m -56.04 -48.81 75.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.741 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 60.3 m -57.21 -55.23 37.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.236 177.289 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.637 ' CD1' HD22 ' B' ' 488' ' ' LEU . 41.6 t80 -52.03 -52.94 47.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.562 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.541 HD11 ' HE2' ' B' ' 468' ' ' PHE . 84.4 mt -56.71 -55.35 20.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.248 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.21 -29.74 63.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -173.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -63.81 -55.27 24.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.343 176.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD23 ' B' ' 523' ' ' LEU . 58.2 t -65.18 -32.21 57.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.637 -175.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.452 ' HD3' HG22 ' A' ' 201' ' ' ILE . 23.8 mtp180 -72.94 -5.29 37.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 112.168 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -122.7 -54.44 1.85 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.481 0.182 . . . . 0.0 111.379 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -127.8 167.87 15.93 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -140.2 13.29 2.41 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.165 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 63.97 6.87 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.786 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -134.39 42.51 2.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 29.5 m -97.6 -7.33 31.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -120.2 126.36 50.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.071 176.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 213' ' ' LEU . . . . . 0.41 HD12 ' N ' ' A' ' 213' ' ' LEU . 6.3 mp -109.27 -39.06 5.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.745 -174.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.04 82.89 3.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.632 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -95.28 129.42 42.42 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -81.2 -173.59 4.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.785 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 47.9 t -73.63 99.38 3.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.264 0.554 . . . . 0.0 111.033 -177.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -88.44 36.14 3.48 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.987 -0.625 . . . . 0.0 111.786 175.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 42.4 t -114.02 140.67 33.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.216 -0.897 . . . . 0.0 109.644 179.04 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 11.4 p . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.747 0.308 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -92.78 115.05 27.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.341 . . . . 0.0 110.68 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -135.56 129.83 33.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.44 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 14.4 m -120.45 173.51 7.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.272 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -101.1 131.78 46.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.029 0.442 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -133.53 147.8 51.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.979 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 71.08 -173.58 42.15 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.827 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 20.3 m -119.54 -169.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.718 0.294 . . . . 0.0 110.648 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 123.39 -2.09 9.59 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.948 -0.644 . . . . 0.0 111.543 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.0 p -86.11 -15.52 40.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.901 0.382 . . . . 0.0 110.732 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.475 ' HA ' ' CH2' ' B' ' 518' ' ' TRP . 3.4 mp0 -58.78 -43.53 90.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.752 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 15.9 m -63.57 -33.01 74.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.003 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 54.8 tp -65.59 -43.25 90.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.21 0.528 . . . . 0.0 109.862 177.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.452 ' O ' HG23 ' B' ' 471' ' ' VAL . 64.6 t80 -54.96 -49.19 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.994 173.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.1 m-85 -66.18 -32.07 73.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.77 -177.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.91 -46.31 91.17 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -60.91 -49.08 78.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.834 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 467' ' ' PHE . 92.5 t -59.49 -51.71 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.841 0.353 . . . . 0.0 111.345 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -58.97 -41.68 88.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.519 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 473' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' B' ' 473' ' ' LYS . 21.9 ttmt -75.77 -34.35 60.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.317 -175.757 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.532 ' HA ' ' HG3' ' A' ' 141' ' ' GLN . . . -79.82 -41.27 26.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.716 -177.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.56 -41.96 87.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 121.101 -0.239 . . . . 0.0 110.831 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' B' ' 476' ' ' ARG . 40.2 ttt180 70.6 -56.12 0.61 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.847 0.717 . . . . 0.0 111.688 176.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 28.4 t -65.89 129.62 40.4 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.082 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.02 -40.95 87.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.946 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.88 -31.11 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 0.0 110.054 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.472 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.64 -43.51 65.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 177.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.491 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 76.8 t80 -65.54 -39.67 91.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 176.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.5 tt0 -60.09 -43.56 95.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.847 174.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.11 -44.7 75.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.821 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.472 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 51.2 t80 -57.53 -48.52 79.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.312 175.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 193' ' ' GLU . 87.2 mt -63.91 -33.1 74.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.171 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.985 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 20.0 mtt85 -66.12 -38.17 87.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.928 0.394 . . . . 0.0 110.452 177.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 53.7 m -62.03 -34.34 76.05 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 173.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.637 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -68.11 -46.85 69.78 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.412 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.498 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.6 m -64.85 -42.57 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.634 -178.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.471 HD13 ' HE1' ' A' ' 186' ' ' PHE . 22.9 pt -69.51 -29.59 42.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.848 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.33 -42.47 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.105 0.479 . . . . 0.0 109.889 172.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -67.26 -32.57 73.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.965 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.53 7.8 16.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 65.62 21.8 11.68 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.371 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.459 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 95.2 t -75.5 -43.07 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.973 0.416 . . . . 0.0 110.096 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.53 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 36.2 pt -120.17 154.96 23.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.717 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 28.3 p -98.99 -171.3 2.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.292 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.567 ' O ' HG23 ' B' ' 502' ' ' VAL . 45.2 ttp180 -55.77 -42.12 75.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.419 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -60.23 -53.4 58.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.571 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.722 ' HG2' HG21 ' A' ' 157' ' ' THR . 2.3 mp0 -60.63 -41.72 95.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.78 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.51 -41.99 86.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.763 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.567 HG23 ' O ' ' B' ' 498' ' ' ARG . 67.3 t -69.4 -40.71 80.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.894 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -74.68 -41.65 59.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.176 -175.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.696 HD21 HD21 ' A' ' 153' ' ' LEU . 91.0 mt -61.26 -36.92 81.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 111.636 -175.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -92.16 6.81 5.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.969 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.526 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 34.9 t -59.77 -48.33 95.37 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.737 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.526 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 24.0 Cg_exo -66.3 -1.56 5.69 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.946 1.764 . . . . 0.0 112.731 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.65 -61.68 1.61 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.764 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' B' ' 505' ' ' VAL . 48.1 mt -89.35 -21.16 23.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.151 -175.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -70.44 -10.18 66.02 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.452 -177.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -79.9 -11.83 59.78 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.463 ' HB2' ' HB3' ' B' ' 515' ' ' LEU . 60.5 m-85 -124.95 104.33 30.0 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.054 -178.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.13 -50.45 13.36 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.523 2.815 . . . . 0.0 113.586 -175.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -66.51 -41.47 88.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.095 0.474 . . . . 0.0 110.665 -177.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 22.2 tp -67.0 -45.71 76.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.727 -175.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -67.28 -32.34 73.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.351 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.15 -47.49 79.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.463 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.475 ' CH2' ' HA ' ' B' ' 464' ' ' GLU . 4.9 t90 -57.16 -48.56 78.4 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.753 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.516 ' CZ ' HD11 ' B' ' 523' ' ' LEU . 39.5 t80 -56.82 -50.69 71.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.495 -178.105 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.2 -38.29 90.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.2 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -44.42 91.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.586 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -63.03 -41.38 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.633 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.573 HD23 HG11 ' A' ' 204' ' ' VAL . 88.7 mt -71.08 -26.64 63.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.489 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.55 33.87 15.32 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -173.374 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -90.65 90.81 8.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -97.35 29.03 3.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.179 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 67.62 18.51 9.91 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.145 -177.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 528' ' ' SER . . . . . 0.413 ' C ' HH22 ' B' ' 498' ' ' ARG . 17.0 m . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.583 -0.722 . . . . 0.0 109.835 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.475 0.798 0 CA-C-O 120.877 0.37 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -78.11 130.97 37.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.479 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -158.3 143.31 16.41 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.33 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 92.12 -154.94 22.68 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.179 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.0 p -91.05 155.31 18.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -89.49 -58.25 2.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.113 0.482 . . . . 0.0 110.294 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -103.77 142.0 35.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.555 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -106.62 152.04 24.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.934 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 138.06 -46.56 0.98 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.357 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 67.8 -97.09 0.4 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.971 -178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -128.36 106.41 8.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 49.4 m -152.65 142.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.861 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 5.5 Cg_exo -76.94 170.93 18.89 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.605 2.203 . . . . 0.0 111.567 178.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 15.3 m -68.93 127.98 31.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.836 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 61.28 92.86 0.05 OUTLIER 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.349 0.595 . . . . 0.0 111.542 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.22 -20.25 27.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.97 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.435 HD13 ' HE2' ' B' ' 511' ' ' LYS . 4.2 pt -136.17 135.49 49.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.527 176.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.626 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.2 t70 -81.43 -64.19 1.24 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.1 m -151.42 96.24 3.24 Favored Pre-proline 0 N--CA 1.452 -0.344 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.303 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 53.7 Cg_exo -54.09 147.94 41.77 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.699 2.266 . . . . 0.0 112.131 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -126.64 149.72 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.122 0.487 . . . . 0.0 111.111 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.626 HG21 HD21 ' B' ' 483' ' ' ASN . 0.8 OUTLIER -95.47 138.73 20.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.915 -175.544 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.46 -46.87 68.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.831 0.824 . . . . 0.0 109.787 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.583 HD23 HD22 ' B' ' 504' ' ' LEU . 40.2 mt 60.28 10.04 2.2 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.527 -1.67 . . . . 0.0 111.553 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -94.03 -10.96 31.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -70.39 -29.95 66.72 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.584 HD21 HD21 ' B' ' 504' ' ' LEU . 19.2 mt -59.31 131.62 51.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.219 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -72.29 163.61 27.67 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.914 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.54 -44.17 80.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.758 0.313 . . . . 0.0 110.744 -178.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 24.8 p30 -61.77 -35.43 78.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 48.1 m -71.78 -46.84 57.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.693 0.282 . . . . 0.0 110.97 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.654 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 88.1 mt -60.84 -46.82 89.05 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.226 0.536 . . . . 0.0 110.46 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.462 ' HA ' ' HD3' ' A' ' 162' ' ' LYS . 29.5 mtp180 -65.12 -31.83 73.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.677 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 156' ' ' ASN . 39.3 ttm180 -67.24 -46.81 72.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.266 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -52.94 -49.76 65.36 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.025 0.44 . . . . 0.0 110.335 174.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 159' ' ' ARG . 7.9 mtpm? -57.7 -45.35 85.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.881 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -81.91 -31.7 31.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.514 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 31.9 t60 -72.57 -37.99 68.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.556 -179.29 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -88.41 -8.07 55.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.239 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm 61.33 69.99 0.63 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.766 0.666 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 84.9 mt -105.93 145.15 30.34 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.233 -178.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 21.5 Cg_exo -65.68 150.73 86.03 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.182 2.588 . . . . 0.0 111.928 176.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 18.7 p -136.55 167.4 21.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.092 0.473 . . . . 0.0 112.115 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 -121.18 151.9 56.32 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.462 176.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -66.45 134.41 35.74 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.231 1.954 . . . . 0.0 111.763 174.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.01 39.89 3.93 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.081 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.55 143.83 53.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.136 0.493 . . . . 0.0 111.314 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.732 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 26.9 m-80 -141.66 177.34 8.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.589 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -56.78 -52.11 66.32 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.182 0.301 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.9 -30.03 69.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.736 0.303 . . . . 0.0 110.847 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.732 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 25.4 mm-40 -64.58 -42.54 95.56 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.146 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 75.3 mt -62.72 -46.97 85.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.056 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.79 -46.03 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.281 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -60.1 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.45 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.2 -49.54 80.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.6 t -59.13 -49.47 83.24 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.91 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.31 92.12 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 121.49 -0.386 . . . . 0.0 112.835 -176.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.48 -48.97 79.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -80.77 -26.14 37.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.034 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.503 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.9 t80 -57.28 -48.59 78.52 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 -179.149 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.9 45.95 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 0.0 111.417 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 61.7 m -152.02 11.38 0.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.196 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.792 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 79.1 mt -89.34 120.93 69.75 Favored Pre-proline 0 C--O 1.234 0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.619 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 190' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 8.1 Cg_exo -72.08 148.07 49.86 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.836 2.357 . . . . 0.0 111.732 177.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.26 129.8 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 0.0 111.327 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 195' ' ' ASP . 26.5 t-20 -91.44 119.63 31.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 169.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 42.4 tt0 -51.63 -54.17 30.72 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.388 0.43 . . . . 0.0 111.474 -173.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -59.24 -51.47 69.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 195' ' ' ASP . . . . . 0.4 ' HB3' ' HB3' ' A' ' 192' ' ' ASN . 38.4 t70 -62.85 -43.94 97.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.328 -176.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 196' ' ' THR . . . . . 0.437 HG21 ' HB3' ' B' ' 485' ' ' LEU . 19.9 m -66.34 -42.69 87.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.299 -176.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 80.3 mt -62.98 -41.82 99.66 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 28.3 m -57.46 -46.23 83.87 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.375 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 95.0 m -56.87 -56.19 24.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.478 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.53 ' CG ' HD22 ' B' ' 488' ' ' LEU . 56.1 t80 -62.72 -55.5 26.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.603 -175.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 67.4 mt -56.43 -55.67 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.231 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.89 -34.82 78.62 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -173.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -64.99 -51.63 60.65 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.724 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD12 ' B' ' 523' ' ' LEU . 44.4 t -68.92 -28.72 40.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -63.7 -21.11 66.23 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.986 0.422 . . . . 0.0 111.05 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -106.14 -64.55 1.15 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.292 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.29 137.19 28.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.158 -173.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.71 39.88 1.12 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.293 0.568 . . . . 0.0 109.599 175.157 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 18.6 m120 63.33 -96.9 0.06 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.007 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 17.5 pttm -155.21 19.85 0.42 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.464 0.65 . . . . 0.0 109.698 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 211' ' ' SER . . . . . 0.418 ' HB2' ' HB3' ' B' ' 497' ' ' SER . 39.1 t -90.58 -8.57 49.86 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.876 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.647 ' HA ' ' NH2' ' B' ' 498' ' ' ARG . 6.9 p-10 -96.03 -5.73 40.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.035 -177.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.8 129.46 39.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -123.3 113.69 19.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.493 -176.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -95.26 -162.16 0.93 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.387 173.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.22 114.39 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 18.0 p -80.92 -33.74 33.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.241 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -177.67 -90.55 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.698 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 59.3 t 71.93 113.26 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-O 121.417 0.627 . . . . 0.0 110.726 -176.283 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 . . . . . 0 C--O 1.241 0.644 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.186 -176.002 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 110.245 -0.279 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -77.29 -23.26 51.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.187 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.75 -58.89 6.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.712 0.291 . . . . 0.0 110.561 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 20.2 m -92.12 76.94 5.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.132 176.174 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 458' ' ' LYS . . . . . 0.515 ' H ' ' HD3' ' B' ' 458' ' ' LYS . 0.3 OUTLIER -74.85 155.49 37.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.465 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -100.27 162.54 12.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.834 0.35 . . . . 0.0 110.571 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 162.28 178.86 36.51 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.9 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 29.1 m -122.64 162.39 22.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.597 0.237 . . . . 0.0 110.534 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 95.89 7.08 58.93 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.691 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.2 t -90.14 -19.57 24.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.634 0.254 . . . . 0.0 110.608 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.473 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -63.58 -38.66 91.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.833 0.349 . . . . 0.0 110.627 177.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 9.9 m -59.26 -43.71 92.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.244 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.73 -48.42 81.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.896 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.2 t80 -53.48 -52.9 58.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.06 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.467 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.0 m-85 -70.18 -28.93 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -174.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.21 -40.79 82.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -57.95 -50.27 73.95 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.368 172.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 467' ' ' PHE . 84.1 t -54.51 -42.23 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.869 0.366 . . . . 0.0 110.976 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -54.93 -51.57 65.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.313 177.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -78.46 -33.23 48.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.834 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.722 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -70.37 -45.84 65.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.75 -30.67 68.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.679 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' B' ' 474' ' ' ALA . 13.3 mtp180 68.94 -51.95 0.58 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.683 0.793 . . . . 0.0 112.427 173.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.626 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 29.4 t -78.77 137.8 37.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.882 -178.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.98 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.594 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.12 -38.77 91.72 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.525 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.16 -47.3 74.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.975 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.467 ' CE2' HD11 ' B' ' 485' ' ' LEU . 91.3 t80 -65.62 -42.92 91.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.543 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.1 tt0 -59.43 -40.81 87.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.676 177.251 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.626 HD21 HG21 ' A' ' 148' ' ' VAL . 3.0 t30 -57.93 -47.61 82.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.686 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -51.73 -49.91 61.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.95 174.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.467 HD11 ' CE2' ' B' ' 481' ' ' TYR . 71.7 mt -63.05 -34.37 77.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.22 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.792 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.2 mtt85 -66.52 -36.54 82.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 51.4 m -61.44 -36.42 80.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.23 0.538 . . . . 0.0 109.657 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 61.9 mt -66.11 -47.74 73.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.569 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.576 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.5 m -65.77 -42.16 91.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -176.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.474 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 22.7 pt -68.48 -31.39 51.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.601 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.18 -42.02 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.291 0.567 . . . . 0.0 110.02 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -65.95 -31.36 72.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.759 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 493' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 77.1 mt-30 -90.39 15.03 11.36 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.552 -177.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 68.75 10.93 8.17 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.128 0.571 . . . . 0.0 112.226 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.474 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 90.0 t -68.85 -55.51 15.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.089 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.419 HG12 HG13 ' B' ' 490' ' ' ILE . 42.3 pt -111.83 152.45 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.436 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 58.2 m -102.5 -177.28 3.35 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.784 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.647 ' NH2' ' HA ' ' A' ' 212' ' ' ASP . 40.2 ttp180 -57.25 -45.94 83.5 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.643 -175.406 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.89 -51.03 71.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.776 0.322 . . . . 0.0 111.036 -178.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.7 mp0 -60.21 -44.33 95.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 179.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.47 -46.85 80.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.067 0.461 . . . . 0.0 110.955 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 498' ' ' ARG . 88.5 t -63.1 -35.91 73.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.883 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -77.56 -30.02 52.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.584 HD21 HD21 ' A' ' 153' ' ' LEU . 86.2 mt -71.21 -39.72 71.58 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.29 7.1 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.255 0.55 . . . . 0.0 110.864 -177.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.641 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 31.7 t -57.95 -52.75 72.16 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.721 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.0 Cg_exo -66.67 -3.39 9.16 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.286 1.991 . . . . 0.0 112.931 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.583 ' CZ ' HG22 ' A' ' 148' ' ' VAL . 95.8 m-85 -109.27 -53.78 2.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.425 -175.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.586 HD22 HD23 ' B' ' 515' ' ' LEU . 87.1 mt -107.1 -6.42 17.41 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -176.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.03 -15.61 69.71 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.006 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' B' ' 512' ' ' PHE . 0.0 OUTLIER -84.75 1.97 44.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.523 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.722 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 87.9 m-85 -128.54 93.33 38.29 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.853 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 513' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.0 Cg_endo -52.55 -54.08 5.78 Favored 'Trans proline' 0 CA--C 1.528 0.198 0 C-N-CA 123.537 2.825 . . . . 0.0 113.345 -173.74 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -66.94 -33.26 75.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 0.0 111.207 -176.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.586 HD23 HD22 ' B' ' 509' ' ' LEU . 16.3 tp -74.84 -39.16 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 110.26 -178.123 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -70.15 -30.31 67.43 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 176.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.31 -45.19 95.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.851 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.473 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 19.0 t90 -56.23 -48.41 76.54 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.744 176.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -47.04 76.99 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.537 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.2 -39.82 91.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -66.46 -37.36 84.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.047 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -71.86 -35.12 69.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.112 0.482 . . . . 0.0 110.395 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.573 HD12 HG11 ' A' ' 204' ' ' VAL . 5.2 mp -86.92 -7.15 58.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.492 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.72 40.27 97.84 Favored Glycine 0 N--CA 1.452 -0.248 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 -175.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -79.08 96.02 5.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.1 0.476 . . . . 0.0 110.675 -173.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -84.27 144.32 28.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.021 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -92.68 -1.14 57.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.38 0.61 . . . . 0.0 110.608 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 C--O 1.25 1.111 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.527 -178.094 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 120.832 0.349 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -78.15 -21.36 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.342 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.98 -61.23 0.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.488 0.715 . . . . 0.0 111.473 -178.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 83.36 26.39 43.7 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.494 -177.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.2 t -146.12 149.16 33.5 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.0 t70 67.95 75.69 0.28 Allowed 'General case' 0 C--N 1.33 -0.257 0 O-C-N 124.247 0.967 . . . . 0.0 111.098 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -114.64 -25.34 8.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.052 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -85.37 174.58 9.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.864 177.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 112.87 -145.76 18.25 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.435 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 92.09 -87.51 1.29 Allowed Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.385 -176.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.401 ' HB3' ' H ' ' A' ' 138' ' ' SER . 4.3 m-20 57.77 -155.07 0.34 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.401 ' H ' ' HB3' ' A' ' 137' ' ' ASP . 19.9 m 71.01 130.7 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 123.086 0.554 . . . . 0.0 110.902 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -45.65 -71.12 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.197 2.598 . . . . 0.0 112.877 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 21.7 t 45.44 76.31 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 121.577 0.703 . . . . 0.0 111.452 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -94.84 133.96 37.99 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.236 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.518 ' O ' HG23 ' A' ' 143' ' ' ILE . 7.7 m-20 52.87 -108.91 0.44 Allowed 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 123.819 0.699 . . . . 0.0 109.474 -177.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.518 HG23 ' O ' ' A' ' 142' ' ' ASP . 1.4 pt -163.37 120.75 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 O-C-N 123.498 0.499 . . . . 0.0 110.729 175.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.559 ' HA ' ' NH1' ' B' ' 476' ' ' ARG . 31.3 t70 -78.4 -51.56 9.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 86.8 m -157.92 103.11 1.76 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.207 175.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 4.5 Cg_exo -74.29 165.22 32.34 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.628 2.218 . . . . 0.0 111.394 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -120.66 152.62 37.96 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.958 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.17 124.83 53.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.136 0.493 . . . . 0.0 110.957 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -81.65 107.06 14.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.772 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.5 mt -91.96 5.27 50.71 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.831 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -80.47 -17.44 51.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -64.68 -27.42 68.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.619 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.536 HD21 HD11 ' B' ' 504' ' ' LEU . 52.1 mt -69.98 142.69 52.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.036 -176.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -70.5 158.14 36.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.073 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.5 t -58.29 -43.1 85.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 110.145 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.99 -40.05 91.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.344 178.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 16.6 m -65.89 -42.8 89.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.107 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 91.8 mt -65.06 -42.01 94.62 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.978 0.418 . . . . 0.0 110.814 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.42 -35.93 82.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.977 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.7 ttm180 -63.66 -39.94 95.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.085 -179.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.465 ' HA ' HG13 ' B' ' 495' ' ' VAL . 54.3 t80 -60.51 -52.27 65.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.544 173.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.636 ' HG2' HD12 ' A' ' 167' ' ' LEU . 19.9 mtpp -66.35 -28.69 68.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.069 -175.142 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -80.04 -39.52 29.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.092 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -70.64 -40.67 72.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.597 0.237 . . . . 0.0 111.232 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -88.6 -0.4 57.22 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.493 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 55.99 82.37 0.11 Allowed 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.677 0.61 . . . . 0.0 111.922 176.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.636 HD12 ' HG2' ' A' ' 162' ' ' LYS . 93.2 mt -114.53 134.1 22.4 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.478 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.61 127.81 7.43 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.527 2.152 . . . . 0.0 112.254 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 10.6 t -173.38 158.29 3.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.258 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.405 ' HD2' ' C ' ' A' ' 170' ' ' ARG . 7.5 ppt_? -83.13 153.98 66.72 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.92 157.44 54.8 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.511 2.14 . . . . 0.0 112.658 -178.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.05 25.84 20.84 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.663 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 64.2 mt -73.68 144.23 45.9 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.981 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 16.7 m120 -80.21 168.21 19.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.773 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.668 ' O ' HG23 ' A' ' 179' ' ' VAL . 17.8 tptm -55.88 -54.52 43.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.519 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.02 73.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.981 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 5.8 mm100 -69.22 -40.85 77.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.013 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 94.5 mt -59.83 -44.66 93.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.883 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 175' ' ' LYS . 37.6 t -57.67 -43.05 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.067 -178.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.03 -48.43 78.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.1 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.93 -46.27 96.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 CA-C-O 120.947 0.403 . . . . 0.0 110.687 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.7 t -59.39 -48.6 86.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.368 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.409 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -58.82 -46.76 93.05 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.376 -0.44 . . . . 0.0 112.714 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.98 -45.64 78.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.928 0.394 . . . . 0.0 111.231 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -79.48 -29.96 41.88 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.923 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.0 t80 -63.47 -43.47 97.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.787 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -68.07 -15.58 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 111.198 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 m -99.33 10.18 41.91 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.566 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.2 mt -83.26 118.98 73.23 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-O 120.651 0.262 . . . . 0.0 111.185 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.09 114.2 3.54 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.104 2.536 . . . . 0.0 110.925 173.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.03 138.28 52.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.128 0.49 . . . . 0.0 111.241 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -100.28 142.15 32.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.855 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.69 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.7 tt0 -63.59 -64.32 0.93 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 194' ' ' LYS . . . . . 0.404 ' C ' ' HD3' ' A' ' 194' ' ' LYS . 1.0 OUTLIER -64.43 -50.08 68.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.19 -171.841 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -55.62 -39.75 71.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.468 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 37.1 m -75.3 -36.81 61.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.072 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 21.8 mt -60.29 -48.13 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 176.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 63.6 m -59.19 -42.67 91.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 68.5 m -56.54 -55.79 29.41 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.187 0.518 . . . . 0.0 111.696 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.722 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 46.6 t80 -63.44 -48.03 79.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.109 -176.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 82.6 mt -57.61 -52.82 52.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -58.59 -37.67 76.31 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 33.1 m -60.66 -52.26 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.884 0.373 . . . . 0.0 110.74 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.608 ' HA ' ' O ' ' A' ' 207' ' ' ASP . 18.9 t -76.54 -24.5 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.915 -174.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.454 ' HD3' HG21 ' B' ' 461' ' ' VAL . 0.4 OUTLIER -67.63 -21.56 65.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.413 . . . . 0.0 110.978 177.788 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -105.54 -47.35 3.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.839 0.352 . . . . 0.0 111.027 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.608 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 3.8 p30 -150.69 -156.15 0.69 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.817 -177.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -133.82 16.08 3.93 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -177.92 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.421 0.451 . . . . 0.0 110.347 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.457 ' NZ ' ' HB3' ' A' ' 210' ' ' LYS . 5.1 ttpm? -165.72 144.77 6.22 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.028 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 2.9 p -82.18 172.96 12.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.12 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.67 92.62 4.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.747 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 4.3 pp -146.4 148.69 32.57 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.122 178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -123.02 41.99 3.32 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.191 0.519 . . . . 0.0 110.098 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -82.53 12.83 4.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.328 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -86.39 116.57 24.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 111.034 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 69.3 m -124.39 20.81 8.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.001 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 134.79 155.97 7.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.322 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 27.2 m -62.1 142.6 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.055 0.455 . . . . 0.0 110.959 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 40.0 m80 . . . . . 0 C--O 1.245 0.864 0 CA-C-O 118.473 -0.775 . . . . 0.0 109.99 -177.445 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.486 0.184 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -148.19 159.22 44.18 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -68.77 177.38 2.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 0.0 111.976 -177.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 13.2 t -78.92 174.24 11.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.146 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -124.37 166.37 16.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.543 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -110.87 15.35 21.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.21 0.528 . . . . 0.0 110.354 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -148.0 -172.46 18.03 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.583 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 461' ' ' VAL . . . . . 0.454 HG21 ' HD3' ' A' ' 205' ' ' ARG . 61.3 t -84.74 -48.18 16.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.845 0.355 . . . . 0.0 110.415 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -158.46 -95.99 0.11 Allowed Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.65 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 2.8 p -90.32 -4.29 57.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -61.17 -40.33 93.51 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.098 0.408 . . . . 0.0 111.063 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 68.4 m -63.12 -34.05 76.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.906 0.384 . . . . 0.0 110.486 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.64 -47.45 69.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.583 ' O ' HG23 ' B' ' 471' ' ' VAL . 74.9 t80 -52.59 -59.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.427 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.722 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 58.6 m-85 -63.55 -39.37 94.24 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -174.189 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.79 -41.41 95.84 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.991 0.424 . . . . 0.0 110.186 177.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.2 -42.32 93.66 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.326 178.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.583 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.9 t -60.67 -51.35 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-O 120.955 0.407 . . . . 0.0 110.204 175.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -55.04 -34.85 63.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.454 -177.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -87.06 -51.03 6.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.818 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -71.39 -25.54 62.4 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -172.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 475' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' B' ' 475' ' ' LEU . 12.1 tp -70.44 -19.76 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.559 ' NH1' ' HA ' ' A' ' 144' ' ' ASP . 2.4 tmt_? 73.59 -43.39 0.55 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 124.071 0.857 . . . . 0.0 111.497 173.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 26.1 t -97.99 125.15 42.79 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.939 0.399 . . . . 0.0 111.273 -177.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -70.76 -27.8 64.2 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.806 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 479' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' B' ' 479' ' ' GLU . 2.6 mp0 -65.16 -44.24 89.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.604 176.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.589 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -65.25 -40.0 93.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.599 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.842 176.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.458 ' HG2' ' HE ' ' B' ' 486' ' ' ARG . 27.5 tt0 -58.57 -44.21 89.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.251 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.45 -40.95 98.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.699 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.65 -47.56 81.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.31 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 83.3 mt -66.07 -30.55 71.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.028 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.624 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.9 mtm105 -68.92 -38.31 79.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.804 0.335 . . . . 0.0 110.793 176.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 55.8 m -60.74 -34.09 73.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.195 0.521 . . . . 0.0 109.857 171.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.543 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.8 mt -69.11 -45.62 69.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.917 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.545 HG22 ' HA ' ' B' ' 486' ' ' ARG . 24.3 m -62.9 -44.6 99.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.102 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 43.6 pt -67.1 -30.46 49.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.941 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -62.27 -45.09 94.84 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.185 0.517 . . . . 0.0 110.31 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -73.33 -29.23 62.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.079 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -81.6 12.77 3.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.448 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 64.52 27.58 13.41 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.032 0.444 . . . . 0.0 111.148 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.571 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.6 t -87.66 -46.85 15.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.653 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.0 pt -120.02 160.96 19.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.231 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.405 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.8 t -100.77 178.44 4.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.104 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.595 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 35.1 ttp180 -54.44 -52.39 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -50.97 -52.91 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.66 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.449 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.2 mp0 -58.29 -47.41 83.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.999 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.6 tp -55.29 -45.64 76.21 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.071 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.562 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 58.2 t -63.52 -38.54 82.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.965 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -74.99 -38.22 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.685 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.536 HD11 HD21 ' A' ' 153' ' ' LEU . 90.1 mt -62.33 -37.16 84.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.785 0.326 . . . . 0.0 111.813 -176.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.454 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -88.78 2.77 6.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.03 0.443 . . . . 0.0 111.183 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.539 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 28.2 t -59.07 -49.23 94.27 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.084 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 51.5 Cg_exo -55.91 -23.93 45.28 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 121.785 1.657 . . . . 0.0 112.571 176.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -87.88 -64.57 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.029 -177.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.668 HD22 HD23 ' B' ' 515' ' ' LEU . 64.7 mt -89.47 3.07 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.785 -172.563 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.43 -27.46 70.84 Favored Glycine 0 N--CA 1.453 -0.174 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.488 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -87.02 1.35 53.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.754 0.311 . . . . 0.0 110.801 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -125.3 85.5 58.27 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.971 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.19 -54.88 3.99 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.154 2.569 . . . . 0.0 113.56 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -62.88 -31.88 73.02 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 111.376 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.668 HD23 HD22 ' B' ' 509' ' ' LEU . 20.9 tp -76.67 -42.04 43.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.281 0.562 . . . . 0.0 110.218 -177.12 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.441 ' HD1' ' HB2' ' B' ' 509' ' ' LEU . 32.1 t80 -70.97 -34.37 71.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.092 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -71.58 -30.51 65.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.724 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -61.44 -48.1 82.68 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.562 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 34.6 t80 -54.96 -43.24 73.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.357 177.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.422 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.3 mttt -62.52 -46.46 88.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.109 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -60.36 -42.17 95.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.756 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -66.7 -41.21 88.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 -176.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.595 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 9.5 mp -82.75 -4.6 58.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.667 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 63.88 37.18 94.28 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.261 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -88.87 112.31 23.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.084 -175.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -125.32 125.25 43.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.58 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -81.63 70.69 8.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.204 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.118 -179.14 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.844 0.354 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -73.8 163.95 27.28 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.41 -33.18 62.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.084 -176.924 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 93.49 -53.71 2.39 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.004 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 25.1 m 62.64 -171.0 0.17 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.645 0.378 . . . . 0.0 110.595 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -144.73 -60.33 0.37 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -76.83 -53.83 7.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.926 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 21.9 t70 67.55 -70.87 0.11 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.461 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -91.09 -59.05 1.42 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.78 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 119.33 155.11 9.69 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.329 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -110.81 153.8 24.86 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.7 m -122.54 98.33 43.63 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-O 120.699 0.285 . . . . 0.0 110.722 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.06 -19.45 10.72 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.961 2.44 . . . . 0.0 112.184 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 98.7 t -122.83 122.15 65.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.58 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -88.43 89.18 7.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.972 0.415 . . . . 0.0 110.212 174.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.412 ' HB2' HH12 ' B' ' 476' ' ' ARG . 10.8 p-10 -86.64 -26.36 24.4 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.763 177.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 36.7 mt 71.99 141.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.441 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -102.19 -55.41 2.48 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.236 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.5 m -161.06 107.12 1.26 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.925 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.426 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 45.0 Cg_endo -73.49 155.39 50.4 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 121.893 1.729 . . . . 0.0 110.845 174.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -129.58 157.4 42.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.903 0.382 . . . . 0.0 111.246 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 148' ' ' VAL . . . . . 0.405 HG11 ' CE2' ' A' ' 186' ' ' PHE . 4.1 p -97.42 125.11 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.726 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 151' ' ' TYR . 18.4 p-10 -94.43 96.62 9.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.344 0.593 . . . . 0.0 109.756 176.462 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.689 HD23 HD11 ' B' ' 504' ' ' LEU . 92.6 mt -71.48 25.27 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.435 ' CD1' HG21 ' A' ' 179' ' ' VAL . 3.3 t80 -96.57 -4.81 40.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 120.958 0.409 . . . . 0.0 109.994 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.65 -24.14 29.17 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.715 HD21 HD13 ' B' ' 504' ' ' LEU . 79.4 mt -62.63 135.52 57.42 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.231 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -74.98 163.26 27.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.405 177.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.91 -35.73 41.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.49 -44.89 95.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.767 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.449 HG23 ' HA ' ' B' ' 496' ' ' ILE . 8.4 m -69.65 -42.41 74.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.085 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.8 mt -61.25 -43.46 98.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.394 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -66.17 -34.86 78.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.74 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.673 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 34.7 ttm180 -68.16 -45.75 72.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.14 -178.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.41 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 48.4 t80 -52.89 -51.6 60.57 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.474 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 10.2 mtpm? -59.95 -38.83 83.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.024 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -76.66 -44.97 31.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.242 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -70.04 -30.9 68.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.601 0.238 . . . . 0.0 111.002 -176.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.528 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 62.6 m-85 -96.15 0.3 51.08 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.185 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.61 75.22 0.34 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.741 0.651 . . . . 0.0 111.846 178.271 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 89.2 mt -110.18 106.82 58.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.906 177.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 32.0 Cg_endo -65.26 125.7 15.01 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.347 2.031 . . . . 0.0 111.784 -178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.525 HG21 HD13 ' A' ' 181' ' ' ILE . 20.3 p -141.95 148.07 38.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.98 -175.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -90.25 156.71 45.91 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.6 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.11 143.97 99.51 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.812 2.341 . . . . 0.0 112.656 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 110.6 31.41 2.99 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.756 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.9 mt -82.14 161.22 22.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.138 0.494 . . . . 0.0 111.06 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.783 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 16.3 t-20 -145.3 169.08 18.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.47 ' HE3' ' O ' ' A' ' 153' ' ' LEU . 22.3 tptm -50.66 -49.64 56.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.751 0.31 . . . . 0.0 110.4 176.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 176' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -63.24 -40.43 97.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.119 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.783 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 62.3 mm-40 -62.57 -46.92 86.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.551 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 83.1 mt -61.21 -43.22 99.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.537 -178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.435 HG21 ' CD1' ' A' ' 151' ' ' TYR . 57.1 t -60.37 -43.34 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.221 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.9 mt-10 -64.18 -41.75 96.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.906 0.384 . . . . 0.0 110.954 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.525 HD13 HG21 ' A' ' 169' ' ' THR . 81.3 mt -68.65 -50.88 51.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.822 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.554 HG12 HD13 ' A' ' 150' ' ' LEU . 77.9 t -58.44 -45.69 89.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.082 177.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 183' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' A' ' 187' ' ' LYS . . . -62.2 -42.05 99.72 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.733 -178.464 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.72 -45.55 93.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.83 0.348 . . . . 0.0 110.555 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -77.24 -29.92 54.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.704 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.405 ' CE2' HG11 ' A' ' 148' ' ' VAL . 45.2 t80 -63.07 -30.64 71.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.635 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 183' ' ' GLY . 72.8 mmtt -67.67 -12.51 60.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.659 178.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 17.0 m -133.87 59.62 1.73 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.067 0.46 . . . . 0.0 111.252 -176.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.802 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 67.8 mt -105.79 119.14 53.43 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.782 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.94 126.86 14.39 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.869 2.379 . . . . 0.0 111.17 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -142.15 131.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.103 0.478 . . . . 0.0 111.537 -175.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -109.36 125.44 52.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.938 177.268 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.6 tt0 -49.32 -62.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -172.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 194' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 194' ' ' LYS . 38.0 ttpt -55.89 -60.25 3.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.54 -42.01 64.02 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.115 0.483 . . . . 0.0 111.376 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 56.9 m -68.72 -41.05 79.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.188 -176.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 60.5 mt -66.11 -48.7 70.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.341 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.1 m -56.34 -46.49 79.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.755 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 199' ' ' CYS . . . . . 0.575 ' HA ' ' CE2' ' A' ' 202' ' ' TYR . 71.2 m -62.2 -48.85 78.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.246 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.585 ' CD1' HD22 ' B' ' 488' ' ' LEU . 82.6 t80 -60.38 -49.29 78.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.861 0.362 . . . . 0.0 110.633 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.49 HD11 ' HE2' ' B' ' 468' ' ' PHE . 61.9 mt -58.0 -52.17 61.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.769 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 202' ' ' TYR . . . . . 0.575 ' CE2' ' HA ' ' A' ' 199' ' ' CYS . 2.2 p90 -69.45 -35.3 75.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.915 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 44.8 m -64.93 -50.99 64.29 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.755 0.312 . . . . 0.0 110.629 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.426 HG21 ' CE1' ' A' ' 200' ' ' PHE . 47.0 t -69.58 -25.58 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.929 -176.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 201' ' ' ILE . 33.6 mtp180 -73.32 -22.04 60.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.775 0.321 . . . . 0.0 111.338 175.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -97.47 -72.97 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.651 -0.249 . . . . 0.0 110.543 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.636 ' HB2' ' HE3' ' A' ' 210' ' ' LYS . 9.9 m-20 -140.29 124.99 18.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' A' ' 209' ' ' ASN . 0.0 OUTLIER -88.81 90.32 8.36 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.55 -175.86 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 209' ' ' ASN . . . . . 0.553 ' OD1' ' HA ' ' B' ' 497' ' ' SER . 10.4 t30 72.37 114.99 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 123.819 0.699 . . . . 0.0 111.873 175.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 210' ' ' LYS . . . . . 0.636 ' HE3' ' HB2' ' A' ' 207' ' ' ASP . 44.4 mttp -112.51 18.99 17.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.122 -177.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 60.1 p -73.97 -53.83 9.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 0.0 111.351 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.55 19.81 19.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.276 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 52.9 tp -61.65 -46.71 88.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 58.1 mttp 63.8 -178.66 0.16 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.255 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -134.69 173.58 11.52 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.192 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -76.72 133.33 39.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.306 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 13.9 m -78.65 -18.76 53.96 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.706 -178.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 113.32 12.56 11.79 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.654 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 45.3 t 74.53 -14.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 123.245 0.618 . . . . 0.0 111.18 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 16.8 t60 . . . . . 0 C--O 1.246 0.891 0 CA-C-O 118.619 -0.705 . . . . 0.0 110.016 -178.863 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 111.66 0.244 . . . . 0.0 111.66 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -104.79 -25.01 12.83 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.744 0.307 . . . . 0.0 111.16 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -113.39 106.0 14.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.29 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 5.3 p -79.25 133.97 36.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.325 178.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -163.9 99.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.22 0.533 . . . . 0.0 111.222 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -165.38 148.28 7.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.04 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -74.65 65.85 2.09 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.92 -178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 22.6 m -123.64 165.12 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.578 0.228 . . . . 0.0 110.586 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 154.01 -38.2 0.69 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.108 -178.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 11.4 t -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.692 0.282 . . . . 0.0 110.722 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' B' ' 464' ' ' GLU . 32.0 mp0 -64.95 -48.08 75.36 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 3.6 m -63.19 -35.92 81.9 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.863 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 59.5 tp -60.41 -49.13 78.79 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.413 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.551 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.0 t80 -53.43 -57.68 9.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.42 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.49 ' HE2' HD11 ' A' ' 201' ' ' ILE . 54.5 m-85 -62.52 -33.6 75.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.508 -175.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.83 -44.76 84.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.231 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -67.73 -32.45 73.07 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.22 176.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 467' ' ' PHE . 76.2 t -59.85 -50.65 79.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.002 0.429 . . . . 0.0 109.935 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 472' ' ' ARG . . . . . 0.435 ' HG3' ' CE1' ' B' ' 481' ' ' TYR . 4.7 mtt-85 -56.28 -49.61 73.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.591 175.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -65.44 -41.38 93.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.049 -175.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -81.64 -40.7 22.52 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -68.39 -39.08 81.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.99 -178.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.412 HH12 ' HB2' ' A' ' 142' ' ' ASP . 43.0 ttm180 71.03 -47.56 0.66 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.72 0.637 . . . . 0.0 111.884 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 27.3 t -72.92 130.54 40.62 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.98 0.419 . . . . 0.0 110.535 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.0 69.79 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.814 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -75.04 -34.28 61.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.53 -42.49 74.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 177.321 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' B' ' 472' ' ' ARG . 60.0 t80 -63.73 -40.49 96.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.066 175.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 30.2 tt0 -65.09 -38.16 89.84 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.87 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 13.9 t-20 -55.35 -47.6 75.51 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.967 174.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 85.8 t80 -53.6 -44.39 69.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.937 176.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.536 ' HB3' HG21 ' A' ' 191' ' ' VAL . 83.1 mt -69.98 -28.96 65.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.383 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.802 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 21.6 mmt85 -63.2 -49.28 74.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.512 0.673 . . . . 0.0 109.335 174.549 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.6 m -57.8 -35.76 71.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.216 176.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.585 HD22 ' CD1' ' A' ' 200' ' ' PHE . 24.8 mt -65.79 -54.45 26.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.309 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.6 m -58.64 -42.53 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.92 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.528 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 20.8 pt -70.6 -31.32 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.881 -0.728 . . . . 0.0 111.161 179.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.22 -37.54 75.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.588 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.81 -30.44 71.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.265 0.555 . . . . 0.0 110.075 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.56 1.02 50.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.327 175.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 56.52 36.94 28.37 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.185 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.673 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.8 t -78.6 -46.24 24.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.408 174.258 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.449 ' HA ' HG23 ' A' ' 157' ' ' THR . 39.8 pt -102.9 141.67 18.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.721 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.553 ' HA ' ' OD1' ' A' ' 209' ' ' ASN . 8.0 m -81.76 179.21 7.92 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.558 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.577 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.4 ttm180 -60.21 -57.87 10.97 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.823 -0.172 . . . . 0.0 110.629 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.96 70.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.018 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.548 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 19.8 mm-40 -61.14 -49.97 75.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.521 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.488 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 61.5 tp -59.35 -45.74 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.879 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.577 HG23 ' O ' ' B' ' 498' ' ' ARG . 57.6 t -61.06 -40.7 86.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.186 -178.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -82.84 -22.41 34.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 153' ' ' LEU . 11.5 tp -67.31 -49.88 62.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.525 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.55 HG22 ' HB2' ' B' ' 508' ' ' PHE . 9.8 p -86.18 13.05 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.55 -176.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.537 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 22.8 t -57.19 -45.07 99.96 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' B' ' 506' ' ' SER . 11.7 Cg_endo -59.24 -17.95 42.12 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.287 1.991 . . . . 0.0 113.009 174.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.55 ' HB2' HG22 ' B' ' 505' ' ' VAL . 27.4 m-85 -105.71 149.12 26.69 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.422 HD22 HD23 ' B' ' 515' ' ' LEU . 71.9 mt 68.56 -17.73 0.18 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 177.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 510' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' B' ' 508' ' ' PHE . . . -65.89 -15.03 61.89 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.501 -0.381 . . . . 0.0 113.295 -176.411 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.451 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.8 mptp? -85.09 -10.39 56.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.109 0.481 . . . . 0.0 109.779 177.161 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -123.2 92.96 48.61 Favored Pre-proline 0 C--O 1.235 0.334 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.95 -175.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.05 -53.53 6.99 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.316 2.677 . . . . 0.0 113.564 -174.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -57.91 -37.42 74.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 111.948 -176.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 509' ' ' LEU . 15.6 tp -79.48 -43.35 23.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.575 -171.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.465 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 0.6 OUTLIER -70.88 -28.41 64.53 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.141 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -67.73 -42.99 81.01 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -53.32 -48.58 68.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.488 ' HZ ' ' HG ' ' B' ' 501' ' ' LEU . 43.0 t80 -55.68 -52.41 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.137 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 58.2 mttp -59.76 -40.39 88.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.94 0.4 . . . . 0.0 111.076 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -69.66 -32.78 71.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.534 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.42 ' CZ ' ' HG3' ' A' ' 205' ' ' ARG . 54.5 t80 -82.41 -31.91 29.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.736 0.779 . . . . 0.0 108.972 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.557 HD23 HG22 ' B' ' 502' ' ' VAL . 15.4 tp -81.76 -10.18 59.43 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.904 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.74 39.24 96.43 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.324 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -73.21 111.36 8.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.907 0.384 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 5.9 mtpt -124.69 8.82 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 527' ' ' GLU . . . . . 0.551 ' OE2' ' HD2' ' B' ' 498' ' ' ARG . 1.8 mp0 -84.91 16.43 3.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.761 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.7 -0.667 . . . . 0.0 110.309 179.652 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 120.674 0.273 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -150.04 -175.25 4.98 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.85 -42.54 6.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.08 0.467 . . . . 0.0 110.483 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.22 140.58 10.11 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.161 -179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.8 m -90.46 -2.38 57.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.392 0.615 . . . . 0.0 110.047 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.21 88.14 7.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.234 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -80.63 -65.45 1.01 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.211 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -96.26 -60.58 1.59 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.509 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -167.55 106.11 0.25 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.612 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -109.29 148.26 17.02 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.863 -0.684 . . . . 0.0 111.941 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.69 -3.11 55.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.701 0.286 . . . . 0.0 110.506 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 62.1 p 46.9 78.68 0.38 Allowed Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.828 -176.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.02 132.59 8.53 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.9 2.4 . . . . 0.0 111.46 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 47.3 t 61.43 87.42 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.367 0.603 . . . . 0.0 111.251 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLN . . . . . 0.405 ' OE1' ' HE3' ' B' ' 511' ' ' LYS . 47.4 mt-30 -72.1 107.74 4.94 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 174.062 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.92 110.64 18.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.822 -174.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -149.2 112.29 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.754 -177.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -83.34 -52.74 6.29 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.8 m -151.79 97.35 3.07 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.505 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.609 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 52.6 Cg_exo -56.55 151.12 47.99 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.761 2.307 . . . . 0.0 112.385 178.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -104.84 142.24 35.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.371 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.97 106.22 19.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.412 0.625 . . . . 0.0 110.316 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -65.56 114.04 4.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.93 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.438 ' HB2' HG13 ' A' ' 179' ' ' VAL . 77.8 mt -100.1 -0.11 39.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.243 0.544 . . . . 0.0 110.369 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -75.3 -20.84 58.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.183 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.443 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 3.0 pt20 -70.29 -25.97 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.457 178.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.44 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -68.29 161.29 27.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.327 0.584 . . . . 0.0 111.29 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.39 158.11 30.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.251 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.416 HG13 ' CD1' ' A' ' 178' ' ' LEU . 51.7 t -59.13 -44.77 92.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.159 0.504 . . . . 0.0 109.658 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 86.5 m-20 -62.09 -35.28 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.082 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 41.4 m -67.36 -45.82 75.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.842 0.353 . . . . 0.0 110.824 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.98 -40.17 90.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.198 0.523 . . . . 0.0 110.802 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 163' ' ' ARG . 94.5 mtt180 -67.03 -37.24 83.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.347 175.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.8 ttm180 -61.46 -45.0 96.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.079 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -53.33 -50.28 65.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.091 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HD3' ' CG2' ' A' ' 169' ' ' THR . 47.5 mttp -58.64 -45.49 89.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.144 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 159' ' ' ARG . 30.8 mmm180 -72.56 -39.29 67.56 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.407 -175.462 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -71.94 -33.72 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 111.344 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.406 ' CE1' HG22 ' B' ' 490' ' ' ILE . 40.4 m-85 -93.29 3.11 56.18 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.421 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt 61.56 48.95 5.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.764 173.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.493 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 85.7 mt -92.55 134.09 28.51 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.134 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.493 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 14.6 Cg_exo -69.39 127.32 14.71 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.032 2.488 . . . . 0.0 111.808 176.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.56 ' HB ' HD11 ' A' ' 173' ' ' LEU . 16.6 p -115.76 132.03 56.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.056 0.455 . . . . 0.0 111.352 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -85.64 154.71 59.1 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.244 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.49 137.67 56.22 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.736 2.291 . . . . 0.0 111.743 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 100.69 39.85 3.07 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.736 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.56 HD11 ' HB ' ' A' ' 169' ' ' THR . 85.8 mt -73.94 142.92 45.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.418 0.628 . . . . 0.0 111.634 -177.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.488 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 11.1 t-20 -136.06 159.93 40.2 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.588 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.65 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.3 tptm -48.16 -54.31 13.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.289 0.368 . . . . 0.0 111.425 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 176' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -61.1 -37.47 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.113 -178.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.488 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 85.3 mm-40 -63.92 -40.96 97.7 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.377 0.608 . . . . 0.0 110.068 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.476 ' O ' HG23 ' A' ' 182' ' ' VAL . 87.9 mt -61.16 -49.77 75.89 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 177.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 175' ' ' LYS . 19.0 t -56.92 -47.06 83.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 O-C-N 123.777 0.673 . . . . 0.0 111.034 -178.424 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.0 mt-10 -58.7 -50.11 75.1 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.3 mt -61.96 -39.0 82.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.858 0.361 . . . . 0.0 110.761 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.606 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 71.9 t -64.02 -49.56 81.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.707 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.43 -33.71 85.61 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.473 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.03 -49.12 79.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.824 0.345 . . . . 0.0 110.298 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -83.57 -23.53 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.056 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.3 t80 -58.54 -40.67 83.61 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.88 0.472 . . . . 0.0 110.67 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.78 0.23 27.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.87 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -107.25 13.77 26.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.809 0.338 . . . . 0.0 111.027 -179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.717 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 74.7 mt -90.89 116.61 66.79 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.899 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.4 112.09 3.45 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.657 2.238 . . . . 0.0 111.345 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.0 p -120.11 137.2 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -108.23 136.38 47.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.178 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -58.25 -61.87 2.25 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -55.98 -55.81 28.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.624 -176.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.09 -49.24 69.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.9 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 38.9 m -69.32 -44.94 70.68 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.402 HD11 ' OH ' ' B' ' 481' ' ' TYR . 56.4 mt -60.12 -41.52 92.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.92 0.39 . . . . 0.0 110.129 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 54.4 m -58.93 -47.55 84.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.86 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.87 -45.97 92.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.575 ' CD1' HD22 ' B' ' 488' ' ' LEU . 65.6 t80 -61.43 -58.86 6.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.312 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.533 HD11 ' HE2' ' B' ' 468' ' ' PHE . 67.8 mt -56.38 -43.41 77.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.025 0.441 . . . . 0.0 110.707 -175.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -62.52 -46.38 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.179 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 21.3 m -68.71 -39.94 80.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.678 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.664 ' HA ' ' HG2' ' A' ' 208' ' ' LYS . 21.6 t -75.69 -25.78 17.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.867 0.365 . . . . 0.0 111.099 -176.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 205' ' ' ARG . 13.3 mtp180 -76.21 -10.43 59.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 110.553 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -121.74 -146.95 0.38 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.466 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -67.01 114.33 5.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.789 0.804 . . . . 0.0 109.316 171.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.664 ' HG2' ' HA ' ' A' ' 204' ' ' VAL . 86.6 mttt -72.61 3.02 5.42 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.152 -1.385 . . . . 0.0 112.187 -172.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -168.25 -72.81 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.377 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 25.8 pttm 179.64 -19.81 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.259 0.223 . . . . 0.0 110.827 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 57.0 m 68.49 104.06 0.05 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.426 0.632 . . . . 0.0 110.878 -177.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.97 84.51 6.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.333 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 79.4 mt -109.92 -56.08 2.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.036 0.446 . . . . 0.0 110.107 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -137.46 174.75 10.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.782 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -100.38 -51.27 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.297 0.57 . . . . 0.0 109.825 176.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -87.61 88.72 7.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.495 177.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 9.1 p -92.47 -80.56 0.36 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.619 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -148.34 96.43 0.17 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 34.4 m -98.55 158.71 3.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 39.2 t-80 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.535 -0.745 . . . . 0.0 109.904 -179.113 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 5.8 p . . . . . 0 N--CA 1.475 0.816 0 CA-C-O 121.296 0.569 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -89.59 130.35 35.91 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.01 0.433 . . . . 0.0 110.689 -176.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -132.44 96.32 3.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.277 175.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 25.5 p -133.8 130.75 38.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.2 137.8 44.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 174.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -81.15 155.1 26.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.579 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 120.46 172.21 14.66 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.307 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.37 -19.4 9.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.821 0.343 . . . . 0.0 110.71 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 141.55 -41.05 1.27 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.855 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.1 t -69.89 -27.04 64.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.863 0.364 . . . . 0.0 111.016 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.412 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 7.2 mp0 -66.68 -52.66 42.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 178.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.0 t -63.01 -34.06 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.885 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 42.2 tp -59.24 -50.85 72.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.829 175.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.525 ' O ' HG23 ' B' ' 471' ' ' VAL . 68.5 t80 -52.91 -52.45 57.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.72 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.533 ' HE2' HD11 ' A' ' 201' ' ' ILE . 35.2 m-85 -62.87 -36.51 83.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -176.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.27 -39.01 86.0 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 470' ' ' LYS . . . . . 0.505 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 64.0 mttm -59.85 -49.65 76.86 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.397 174.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.601 HG13 HD21 ' B' ' 509' ' ' LEU . 64.2 t -55.95 -48.0 79.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 121.334 0.587 . . . . 0.0 110.302 177.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -59.59 -33.67 71.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.05 -177.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -86.26 -50.18 7.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.415 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -67.76 -32.4 72.96 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.86 -21.04 66.03 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 64.93 0.43 1.2 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -134.82 129.98 35.35 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.915 0.388 . . . . 0.0 110.86 -177.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.03 -39.23 90.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.364 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.12 -31.51 72.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.96 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.609 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.78 -47.19 79.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 75.8 t80 -65.75 -35.9 82.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.832 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 482' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.29 -38.03 89.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.442 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' B' ' 486' ' ' ARG . 7.1 t30 -72.78 -30.99 64.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.12 0.486 . . . . 0.0 110.323 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 68.4 t80 -60.48 -50.48 73.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.314 0.578 . . . . 0.0 109.471 171.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 75.5 mt -64.83 -29.1 70.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.457 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.717 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 2.4 tpp85 -60.19 -49.11 78.9 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.861 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 37.9 m -63.04 -31.13 72.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.57 175.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 200' ' ' PHE . 33.6 mt -68.88 -45.19 71.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.585 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.2 m -65.83 -40.73 88.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.264 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.553 HD13 ' HE1' ' A' ' 186' ' ' PHE . 39.9 pt -67.84 -32.44 56.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 119.689 -0.804 . . . . 0.0 110.487 177.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -63.93 -43.03 97.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.251 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -63.5 -29.64 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.186 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 493' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 79.3 mt-30 -95.17 17.84 13.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.799 -177.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 59.95 27.15 16.48 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.407 0.683 . . . . 0.0 112.056 177.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.522 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 88.0 t -78.21 -41.56 26.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.303 0.573 . . . . 0.0 109.606 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 48.1 pt -124.68 154.17 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.819 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.3 t -102.94 -169.4 1.65 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.421 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.515 ' O ' HG23 ' B' ' 502' ' ' VAL . 19.5 ttm180 -55.54 -55.48 31.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.442 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -54.01 -50.45 66.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.486 -176.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.545 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 2.4 mp0 -59.91 -46.31 89.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.118 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.422 HD23 HD21 ' B' ' 523' ' ' LEU . 65.2 tp -57.83 -44.7 86.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.918 0.39 . . . . 0.0 111.114 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.64 HG22 HD23 ' B' ' 523' ' ' LEU . 59.7 t -67.79 -36.39 75.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.443 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 70.1 mt-30 -77.27 -35.11 55.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.266 -177.048 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 91.1 mt -65.7 -37.71 87.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 0.0 111.503 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.7 p -87.11 6.7 2.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.967 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.6 t -59.01 -49.2 94.62 Favored Pre-proline 0 CA--C 1.542 0.638 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.741 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 36.8 Cg_exo -63.06 -6.38 9.51 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.228 1.952 . . . . 0.0 113.132 177.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.479 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 68.3 m-85 -108.4 -66.02 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.665 -178.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.601 HD21 HG13 ' B' ' 471' ' ' VAL . 82.4 mt -90.99 -13.15 33.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.72 -12.06 66.81 Favored Glycine 0 C--O 1.23 -0.109 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.077 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.405 ' HE3' ' OE1' ' A' ' 141' ' ' GLN . 28.8 mtpp -80.15 -13.66 59.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.352 0.596 . . . . 0.0 109.8 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.76 89.47 47.84 Favored Pre-proline 0 N--CA 1.451 -0.416 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.809 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 513' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' B' ' 517' ' ' ASN . 74.4 Cg_exo -51.88 -35.94 61.68 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.319 2.679 . . . . 0.0 113.313 -177.009 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.18 -48.64 50.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.275 0.559 . . . . 0.0 110.408 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.524 HD23 HD22 ' B' ' 509' ' ' LEU . 18.0 tp -67.07 -38.8 86.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.475 0.655 . . . . 0.0 110.044 -178.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -67.29 -32.33 73.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.031 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 517' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' B' ' 513' ' ' PRO . 0.2 OUTLIER -64.75 -40.46 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.821 176.721 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.412 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 9.7 t90 -58.65 -49.22 78.31 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.553 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 18.2 t80 -56.95 -46.08 82.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.909 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.66 -37.05 85.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.172 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -65.34 -38.91 91.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.438 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -82.42 -35.02 28.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.562 0.696 . . . . 0.0 109.745 -175.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.64 HD23 HG22 ' B' ' 502' ' ' VAL . 11.8 tp -85.31 -24.9 27.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.367 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 88.87 26.99 25.22 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.638 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -86.92 124.22 32.89 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.844 0.354 . . . . 0.0 110.272 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -119.59 151.19 39.06 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.64 177.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.78 57.71 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.029 0.442 . . . . 0.0 110.792 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.822 -0.609 . . . . 0.0 109.966 -179.748 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 27.6 t . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.496 0.189 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -66.72 -60.13 2.96 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.728 0.299 . . . . 0.0 110.303 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -134.91 149.65 50.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.275 176.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -136.91 84.25 0.25 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.292 -179.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 p -129.23 14.52 6.17 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.064 0.459 . . . . 0.0 110.629 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.24 167.95 18.33 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.632 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.2 t70 73.78 -73.03 0.1 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.979 0.799 . . . . 0.0 111.119 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -149.27 111.03 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.626 0.25 . . . . 0.0 110.895 178.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -75.37 -46.95 13.67 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.293 175.095 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 100.3 48.68 1.53 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.474 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -82.04 -54.14 5.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.714 0.292 . . . . 0.0 111.113 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.0 m -76.88 119.13 76.19 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.177 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.95 161.02 21.04 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.769 2.313 . . . . 0.0 112.136 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' VAL . . . . . 0.523 HG13 ' HB3' ' B' ' 511' ' ' LYS . 39.8 t -107.6 90.04 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 120.833 0.349 . . . . 0.0 110.526 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -160.69 88.53 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.405 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 3.5 t70 63.59 114.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 O-C-N 124.117 0.886 . . . . 0.0 112.35 174.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.552 ' O ' ' HD2' ' B' ' 476' ' ' ARG . 1.1 pp -118.11 144.41 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.591 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.4 t70 -102.4 -46.25 4.84 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.31 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.2 m -154.32 95.35 2.74 Favored Pre-proline 0 C--O 1.234 0.278 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.576 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 7.4 Cg_exo -70.81 147.23 55.65 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.305 2.003 . . . . 0.0 111.064 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -107.92 152.44 24.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.892 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 5.5 p -99.6 121.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.148 0.499 . . . . 0.0 110.348 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -77.57 121.09 23.43 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 504' ' ' LEU . 85.3 mt -109.38 8.27 25.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.153 0.501 . . . . 0.0 110.616 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -90.8 -25.94 19.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.446 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.472 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 25.6 pt20 -63.71 -26.42 68.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.458 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' B' ' 500' ' ' GLU . 63.7 mt -66.31 161.8 21.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.404 -177.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -79.15 154.63 29.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.606 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.566 HG13 ' CD1' ' A' ' 178' ' ' LEU . 37.0 t -61.31 -39.25 82.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.808 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 5.6 p30 -64.66 -30.01 71.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.541 0.21 . . . . 0.0 110.479 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 17.2 m -68.9 -45.96 69.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.127 0.489 . . . . 0.0 110.395 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.4 mt -65.28 -41.3 94.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.713 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 163' ' ' ARG . 82.8 mtp180 -66.35 -33.36 75.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.455 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 18.3 ttm180 -65.41 -44.71 86.57 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.548 ' HA ' HG13 ' B' ' 495' ' ' VAL . 68.0 t80 -55.74 -50.16 71.13 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.552 174.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.457 ' NZ ' HG21 ' A' ' 181' ' ' ILE . 21.3 mtpp -64.66 -38.71 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.442 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 81.8 mtp180 -76.9 -34.77 57.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.764 0.316 . . . . 0.0 110.738 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -69.85 -47.68 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -85.06 -1.89 57.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.443 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm 58.49 81.36 0.16 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.722 0.639 . . . . 0.0 111.129 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.43 HD12 ' HG2' ' A' ' 162' ' ' LYS . 82.4 mt -116.19 100.53 53.56 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.626 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.47 141.72 89.86 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.263 2.642 . . . . 0.0 111.978 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.417 ' CG2' HD11 ' A' ' 173' ' ' LEU . 4.1 t -167.98 146.42 4.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.712 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -74.59 157.81 85.69 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.13 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.34 171.43 12.85 Favored 'Trans proline' 0 C--O 1.234 0.307 0 C-N-CA 122.602 2.201 . . . . 0.0 112.08 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 81.69 33.58 27.21 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.793 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.417 HD11 ' CG2' ' A' ' 169' ' ' THR . 83.5 mt -82.85 147.03 28.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 111.29 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -120.09 -175.56 3.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.726 176.322 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.669 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.6 tptm -58.87 -58.37 8.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.233 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.28 69.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 0.0 111.359 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -59.96 -50.45 73.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.306 0.574 . . . . 0.0 110.739 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.566 ' CD1' HG13 ' A' ' 155' ' ' VAL . 68.1 mt -60.51 -43.65 96.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.9 t -57.85 -45.76 87.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.972 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.62 -46.6 89.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.08 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.457 HG21 ' NZ ' ' A' ' 162' ' ' LYS . 63.1 mt -65.4 -45.72 92.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.3 t -60.74 -49.54 84.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.787 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.13 -38.56 95.8 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.169 -0.538 . . . . 0.0 112.235 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.21 -51.55 69.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.575 0.226 . . . . 0.0 110.772 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -80.83 -24.5 38.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.744 0.307 . . . . 0.0 111.183 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.444 ' CE1' HD13 ' B' ' 490' ' ' ILE . 15.5 t80 -61.48 -44.64 96.74 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.452 -178.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -82.37 22.6 0.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 111.416 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -126.99 22.58 6.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.169 0.509 . . . . 0.0 110.143 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.714 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.9 mt -97.72 118.83 63.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.183 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 190' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 7.1 Cg_exo -72.93 113.48 3.78 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 122.969 2.446 . . . . 0.0 110.807 174.305 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.7 p -119.49 156.43 21.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.877 0.37 . . . . 0.0 111.18 -172.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 192' ' ' ASN . . . . . 0.501 ' O ' ' HB ' ' A' ' 196' ' ' THR . 92.3 m-20 -107.71 147.84 30.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.093 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.7 tt0 -72.28 -66.4 0.65 Allowed 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.597 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -73.43 -45.25 55.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.495 -172.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.76 -42.74 99.82 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.158 -176.192 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 196' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 192' ' ' ASN . 99.4 m -72.68 -38.03 67.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.359 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 37.6 mt -57.69 -51.01 71.28 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 19.5 m -58.49 -44.73 89.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.623 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.2 t -55.06 -54.72 39.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.361 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.593 ' CD1' HD22 ' B' ' 488' ' ' LEU . 70.0 t80 -57.79 -48.65 79.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.616 -177.569 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 197' ' ' LEU . 91.7 mt -54.89 -51.7 50.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.944 -178.025 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -67.42 -30.73 70.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.741 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.8 m -63.64 -52.03 62.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 0.0 110.931 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.7 t -68.63 -27.67 37.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.166 0.508 . . . . 0.0 110.264 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.4 ' HD3' HG22 ' A' ' 201' ' ' ILE . 68.8 mtp180 -87.5 16.1 5.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.362 176.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 8.1 m-20 -120.64 -82.69 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.582 175.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.532 ' CG ' ' H ' ' A' ' 208' ' ' LYS . 5.2 p-10 -142.45 -94.88 0.12 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.763 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.532 ' H ' ' CG ' ' A' ' 207' ' ' ASP . 70.9 mmtt 59.92 80.06 0.21 Allowed 'General case' 0 C--N 1.328 -0.332 0 O-C-N 123.57 0.544 . . . . 0.0 110.859 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 63.7 t30 75.35 168.94 0.28 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.399 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 59.6 tttp 72.92 116.4 0.05 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.295 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 29.8 m -69.73 -30.51 68.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.568 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 212' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 213' ' ' LEU . 37.9 t70 61.56 87.35 0.1 Allowed 'General case' 0 C--O 1.233 0.185 0 O-C-N 123.849 0.718 . . . . 0.0 110.083 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 213' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 212' ' ' ASP . 10.6 mp 69.36 106.16 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.834 -1.076 . . . . 0.0 111.117 -175.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 25.4 ttmm -83.41 -29.2 28.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.907 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -147.3 144.41 28.78 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.853 178.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -68.06 -39.4 82.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.804 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 6.6 t -159.31 149.63 19.22 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -166.25 59.08 0.24 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.084 178.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 7.8 p -65.48 126.46 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.135 0.493 . . . . 0.0 110.812 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 29.2 m80 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.602 -0.713 . . . . 0.0 110.353 178.528 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 35.7 m . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 120.641 0.258 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -130.19 129.0 42.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.711 0.291 . . . . 0.0 110.798 -178.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -154.42 141.52 19.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.877 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 8.1 t -95.95 85.29 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.969 0.414 . . . . 0.0 110.711 -178.743 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt 56.52 -85.47 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.212 1.005 . . . . 0.0 112.763 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 32.4 m170 65.59 88.76 0.1 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.073 0.549 . . . . 0.0 111.043 -173.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -107.38 -111.45 3.55 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.28 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 5.4 p -100.41 160.27 3.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 133.12 -6.4 5.06 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.5 t -82.97 -1.63 52.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.52 . . . . 0.0 110.825 -178.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' B' ' 464' ' ' GLU . 1.9 mp0 -58.81 -36.83 75.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.906 174.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.3 t -60.01 -39.49 85.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.839 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.415 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 59.9 tp -60.56 -49.07 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.065 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 467' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -53.73 -54.92 31.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.777 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.478 ' HE2' HD11 ' A' ' 201' ' ' ILE . 38.6 m-85 -65.32 -33.56 76.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.73 -175.334 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.53 -42.76 98.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.982 0.42 . . . . 0.0 110.133 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 65.8 mttm -58.42 -51.29 70.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.27 174.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . 93.8 t -57.07 -44.35 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.95 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -58.03 -37.44 74.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.382 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -86.86 -38.42 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.979 0.419 . . . . 0.0 111.351 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -65.88 -49.19 68.98 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 -174.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.75 -31.14 72.22 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.216 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.552 ' HD2' ' O ' ' A' ' 143' ' ' ILE . 34.9 ttm180 69.32 -59.47 0.48 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.951 0.782 . . . . 0.0 111.986 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.591 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 14.1 t -64.42 130.8 45.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -178.04 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.43 78.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.326 176.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -69.63 -39.27 77.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.62 -44.39 82.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.156 177.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 485' ' ' LEU . 84.5 t80 -64.91 -41.14 95.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.931 0.396 . . . . 0.0 110.045 177.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.2 tt0 -60.07 -43.42 95.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.547 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.6 -45.26 89.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.811 178.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.491 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 63.3 t80 -54.33 -48.78 70.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.359 174.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.422 HD11 ' CE2' ' B' ' 481' ' ' TYR . 82.9 mt -63.88 -34.7 78.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.943 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.714 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 18.9 mtt85 -66.23 -36.98 84.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.744 0.307 . . . . 0.0 110.339 176.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.37 -34.27 75.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.488 . . . . 0.0 109.752 174.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.593 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.7 mt -68.23 -45.14 74.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.453 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' B' ' 486' ' ' ARG . 14.9 m -67.14 -42.5 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.694 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.444 HD13 ' CE1' ' A' ' 186' ' ' PHE . 28.0 pt -68.54 -31.18 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.515 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.2 -43.91 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.146 173.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.3 -37.33 85.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.199 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.8 16.0 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.772 -176.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 67.35 10.95 8.11 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 122.608 0.363 . . . . 0.0 111.665 177.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 161' ' ' TYR . 77.2 t -70.91 -42.46 77.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 111.61 -174.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 45.3 pt -117.56 151.25 19.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.732 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.709 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 13.5 m -75.49 160.03 30.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' B' ' 501' ' ' LEU . 16.5 ttp180 -67.48 -36.54 81.32 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.802 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -64.54 -43.95 92.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.349 . . . . 0.0 110.333 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.717 ' HB3' HD22 ' A' ' 153' ' ' LEU . 9.3 mm-40 -55.86 -38.8 70.6 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.656 176.077 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.433 ' HB3' ' O ' ' B' ' 498' ' ' ARG . 60.2 tp -61.58 -49.78 75.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.471 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.604 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.4 OUTLIER -59.21 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.176 0.512 . . . . 0.0 109.791 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 503' ' ' GLN . . . . . 0.472 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 44.9 mt-30 -66.51 -42.0 87.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.806 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.551 HD21 HD11 ' A' ' 153' ' ' LEU . 50.2 mt -61.02 -41.97 97.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.878 0.37 . . . . 0.0 111.544 -178.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -87.09 4.06 4.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.016 -178.324 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.513 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 33.7 t -58.83 -48.39 96.91 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.944 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 52.7 Cg_exo -56.73 -20.66 36.04 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.808 1.672 . . . . 0.0 112.734 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.434 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 72.8 m-85 -96.66 -60.59 1.57 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.182 -175.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.711 ' HG ' HG22 ' B' ' 505' ' ' VAL . 55.6 mt -84.61 -19.84 32.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.077 -175.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.16 -8.92 52.66 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.316 -0.468 . . . . 0.0 112.344 -179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.523 ' HB3' HG13 ' A' ' 140' ' ' VAL . 55.6 mttm -73.31 -21.58 60.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 174.264 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.643 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 31.8 m-85 -128.0 101.96 22.31 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.86 -49.55 16.57 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.124 2.549 . . . . 0.0 112.704 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -56.9 -43.9 81.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 0.0 111.336 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.58 -44.58 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.998 -174.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 7.9 t80 -70.34 -29.94 66.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.429 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -67.27 -42.26 84.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.842 176.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -54.96 -48.52 73.1 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.484 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.529 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 29.5 t80 -56.45 -51.38 68.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.967 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.457 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 99.2 mttt -59.53 -34.98 73.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.855 0.359 . . . . 0.0 110.917 178.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -66.69 -35.33 79.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.013 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -78.91 -34.09 44.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.22 0.533 . . . . 0.0 110.367 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.451 ' CD2' HG22 ' B' ' 502' ' ' VAL . 11.0 mp -80.7 -16.26 54.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.401 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 69.85 37.11 75.0 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.287 -175.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -86.41 86.7 7.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.111 0.481 . . . . 0.0 110.446 -176.361 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.32 114.69 22.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.258 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -90.59 5.52 47.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.406 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.251 1.169 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.516 179.849 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.9 m . . . . . 0 N--CA 1.475 0.791 0 CA-C-O 120.556 0.217 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 49.7 t30 74.48 -65.11 0.36 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.613 0.765 . . . . 0.0 111.275 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -92.07 111.05 22.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.632 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -114.2 -176.2 19.0 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.914 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 m -89.82 127.32 35.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.945 0.402 . . . . 0.0 111.175 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -87.09 -56.79 3.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.273 0.558 . . . . 0.0 109.558 176.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -76.77 -43.88 35.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.874 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 25.0 t70 57.96 67.88 0.9 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.396 177.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -104.3 48.91 0.96 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.505 -0.771 . . . . 0.0 113.312 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -103.47 -37.07 3.13 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.5 -0.857 . . . . 0.0 110.96 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -85.7 -31.59 22.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.06 -0.57 . . . . 0.0 110.509 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 24.0 t -134.72 127.36 18.45 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.694 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.86 174.17 13.29 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.551 2.168 . . . . 0.0 112.527 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.89 121.26 11.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.767 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -138.03 110.65 7.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.231 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' B' ' 477' ' ' SER . 18.4 t70 -91.52 -3.25 56.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 173.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' ILE . . . . . 0.44 ' HB ' ' HD3' ' A' ' 146' ' ' PRO . 10.5 mm 66.8 17.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.488 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 37.7 t70 61.32 13.4 4.9 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 113.879 -1.509 . . . . 0.0 110.632 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m 65.39 94.29 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.586 -176.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.639 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 31.6 Cg_exo -58.86 152.63 56.19 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.707 2.271 . . . . 0.0 111.756 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -123.53 135.65 54.13 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 -174.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.1 p -96.23 124.77 49.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.315 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 50.9 m-20 -86.39 110.82 19.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.25 176.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' LEU . . . . . 0.436 HD13 HG12 ' A' ' 182' ' ' VAL . 65.8 mt -90.68 -3.84 57.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.423 0.63 . . . . 0.0 109.885 177.109 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -77.1 -11.16 59.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.36 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 29.7 pt20 -90.63 -9.38 47.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.291 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.8 mt -77.08 166.06 23.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.2 0.524 . . . . 0.0 111.649 -175.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 154' ' ' GLN . . . . . 0.437 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 90.5 mt-30 -71.97 154.84 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.343 176.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.94 -42.56 93.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.615 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -68.34 -31.55 71.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.364 -179.044 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.437 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 10.0 m -66.12 -42.39 89.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.264 0.554 . . . . 0.0 110.469 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 75.7 mt -65.49 -41.62 93.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.249 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.66 -39.21 93.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.248 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.425 ' HG3' ' HA ' ' B' ' 495' ' ' VAL . 27.2 tpt180 -56.88 -52.89 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.477 177.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -52.34 -52.28 54.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.06 176.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.58 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 58.6 mtpt -65.37 -31.5 72.64 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.598 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.71 -47.85 20.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.605 0.24 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 164' ' ' HIS . . . . . 0.431 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 16.0 t-80 -70.09 -35.98 74.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.791 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.452 ' CE1' HG22 ' B' ' 490' ' ' ILE . 59.0 m-85 -88.86 6.38 39.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.626 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt 56.76 51.42 10.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.73 175.289 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 90.7 mt -91.76 131.49 35.56 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.575 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 36.0 Cg_exo -59.84 150.16 79.25 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.936 2.424 . . . . 0.0 111.855 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.4 p -132.56 162.64 30.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.644 -177.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -119.83 151.76 52.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.921 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.22 137.57 79.71 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.428 2.086 . . . . 0.0 112.007 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 83.16 65.27 1.6 Allowed Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.744 -0.741 . . . . 0.0 111.829 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.81 141.32 32.39 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.409 0.623 . . . . 0.0 111.306 178.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.528 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 17.1 t-20 -137.48 166.6 23.47 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.076 -0.965 . . . . 0.0 108.671 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.612 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.8 tptm -50.3 -53.12 30.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.358 0.411 . . . . 0.0 110.699 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 176' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.79 -40.61 88.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.445 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 24.6 mm-40 -60.05 -46.2 90.31 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.487 0.66 . . . . 0.0 110.257 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 77.2 mt -60.73 -51.13 70.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.171 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 175' ' ' LYS . 46.3 t -57.28 -43.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.275 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 180' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 47.6 mt-10 -58.74 -55.57 33.4 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.283 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 181' ' ' ILE . . . . . 0.58 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 63.8 mt -63.22 -42.24 95.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.607 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 47.2 t -58.66 -49.73 81.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.231 177.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 183' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -64.57 -37.24 94.15 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.131 -0.556 . . . . 0.0 112.247 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.1 t -56.67 -48.1 78.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.741 0.305 . . . . 0.0 110.651 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -83.58 -24.73 31.4 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.752 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 54.4 t80 -60.9 -34.28 74.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 187' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 64.4 mttm -81.69 -1.03 45.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.896 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.4 t -130.96 45.63 2.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 110.285 -175.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.716 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 64.2 mt -103.16 115.1 64.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.677 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.36 110.1 1.51 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.349 2.033 . . . . 0.0 111.131 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.449 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.6 p -134.18 128.66 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.067 0.461 . . . . 0.0 111.165 -174.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -104.42 126.45 51.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.097 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 38.5 tt0 -49.69 -65.21 0.6 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -172.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -58.44 -50.04 75.14 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -60.45 -41.6 94.42 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.934 -179.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 66.8 m -66.78 -41.6 87.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 27.5 mt -58.31 -49.22 77.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.559 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -57.2 -47.24 81.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.04 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 78.2 m -58.46 -54.85 42.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.074 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.495 ' CG ' HD22 ' B' ' 488' ' ' LEU . 92.6 t80 -60.94 -47.09 88.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.225 -176.021 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.439 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 73.0 mt -57.58 -53.49 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.185 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -70.82 -22.66 62.31 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.287 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 72.3 m -67.57 -50.81 56.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.652 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 207' ' ' ASP . 37.4 t -73.73 -25.06 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 111.068 -177.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 12.2 mmm180 -61.96 -25.72 67.78 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.138 177.13 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -95.02 -56.69 2.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.738 0.304 . . . . 0.0 110.452 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 207' ' ' ASP . . . . . 0.605 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 8.8 t70 -153.22 -161.57 1.3 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 10.1 mptt -113.65 15.4 18.86 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -179.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 63.73 50.1 2.77 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -113.89 134.25 54.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.901 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 1.3 m -90.88 91.56 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.634 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -101.35 -49.04 4.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.978 0.418 . . . . 0.0 110.264 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.45 112.15 15.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.471 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -145.19 114.25 6.97 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.712 -178.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 56.32 83.6 0.09 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.129 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -105.86 -53.42 2.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.601 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 19.0 m -80.43 95.22 6.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.916 0.389 . . . . 0.0 110.193 178.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -123.6 32.21 4.35 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.077 -0.582 . . . . 0.0 111.897 -177.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.51 -23.64 26.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.841 0.353 . . . . 0.0 110.877 -179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 80.9 t60 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.472 -0.775 . . . . 0.0 109.745 177.472 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.791 0.329 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -85.08 -42.5 14.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.499 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . 64.08 101.06 0.03 OUTLIER 'General case' 0 C--O 1.235 0.302 0 O-C-N 123.931 0.769 . . . . 0.0 111.348 -177.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 2.5 p -69.36 138.66 53.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.9 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -132.59 105.14 7.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.487 -178.12 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 59.13 49.48 9.24 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.416 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 154.23 177.29 27.48 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.493 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 56.9 t -109.3 -49.06 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.854 0.359 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 162.92 -173.62 39.15 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.098 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.3 p -73.86 -12.69 60.75 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.12 -52.01 67.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.963 0.411 . . . . 0.0 109.958 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.1 m -62.26 -34.54 76.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.444 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.01 -48.81 78.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.349 177.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.554 ' O ' HG23 ' B' ' 471' ' ' VAL . 61.3 t80 -52.5 -55.72 20.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.834 176.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.534 ' CD1' HD22 ' A' ' 197' ' ' LEU . 79.2 m-85 -65.04 -32.78 74.67 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -174.396 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -63.19 -41.81 99.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.127 0.489 . . . . 0.0 109.897 174.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -68.36 -33.66 74.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.85 176.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 467' ' ' PHE . 97.2 t -61.47 -49.22 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 177.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -62.77 -35.15 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.151 0.5 . . . . 0.0 109.869 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -76.27 -23.85 54.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.467 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -88.42 -54.98 3.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.355 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.61 -44.35 96.53 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 68.46 -56.95 0.5 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.011 0.819 . . . . 0.0 112.588 173.964 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 142' ' ' ASP . 21.8 t -59.11 137.96 57.75 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.798 0.439 . . . . 0.0 110.802 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -60.32 -55.92 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.309 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.93 -32.82 72.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.639 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -68.77 -50.97 46.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.473 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.27 -37.43 85.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.992 0.425 . . . . 0.0 110.328 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.711 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 26.4 tt0 -67.21 -34.54 77.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.77 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 483' ' ' ASN . . . . . 0.408 ' HA ' ' CG ' ' B' ' 486' ' ' ARG . 3.5 t30 -59.94 -43.4 94.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.434 175.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.1 -45.33 79.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.08 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.3 mt -66.51 -29.52 69.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.116 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.716 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 17.6 mmt85 -60.46 -46.25 90.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 174.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.7 m -61.97 -34.94 77.06 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.667 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.495 HD22 ' CG ' ' A' ' 200' ' ' PHE . 38.8 mt -66.61 -49.37 66.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.525 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 9.7 m -64.71 -42.01 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.672 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.452 HG22 ' CE1' ' A' ' 165' ' ' PHE . 12.1 pt -69.91 -31.11 46.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.128 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 491' ' ' PHE . . . . . 0.499 ' HB2' HD12 ' B' ' 501' ' ' LEU . 91.2 t80 -65.44 -44.0 88.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.167 0.508 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.19 -35.52 79.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.653 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 493' ' ' GLN . . . . . 0.431 ' HB3' ' CE1' ' A' ' 164' ' ' HIS . 77.7 mt-30 -83.62 14.6 3.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.644 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 62.22 28.91 17.3 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.643 0.259 . . . . 0.0 111.149 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.425 ' HA ' ' HG3' ' A' ' 160' ' ' ARG . 69.1 t -87.46 -50.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.067 -178.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 46.4 pt -111.26 148.08 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 54.3 p -91.7 -178.66 5.12 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.446 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.711 ' HD3' ' HB2' ' B' ' 525' ' ' TYR . 26.6 ttm180 -55.99 -52.3 64.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.55 -48.35 81.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.352 -177.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.487 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.7 mm-40 -57.21 -46.77 82.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.605 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' B' ' 491' ' ' PHE . 9.6 tt -61.76 -49.29 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.051 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 498' ' ' ARG . 94.7 t -63.15 -30.68 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.878 0.371 . . . . 0.0 111.008 -176.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.11 -36.65 55.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.696 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 67.4 mt -65.63 -41.19 92.94 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.876 0.37 . . . . 0.0 111.506 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 7.3 p -84.25 8.84 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.17 0.51 . . . . 0.0 111.206 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.651 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.6 t -57.46 -53.05 69.6 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.054 -179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.651 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 17.1 Cg_exo -69.09 0.2 5.48 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 122.409 2.073 . . . . 0.0 112.93 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.459 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 81.6 m-85 -109.56 -69.35 0.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.822 0.344 . . . . 0.0 110.565 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 516' ' ' PHE . 70.0 mt -86.75 -16.85 35.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.626 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.22 -15.29 65.26 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.277 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -84.18 -11.91 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.182 0.515 . . . . 0.0 110.2 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -123.03 93.71 48.0 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.692 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.51 -54.14 5.95 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.641 2.894 . . . . 0.0 113.555 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.74 -34.91 70.02 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.497 HD12 ' HA ' ' B' ' 515' ' ' LEU . 4.4 tp -80.56 -39.95 26.78 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.001 0.429 . . . . 0.0 110.257 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 2.9 t80 -67.61 -38.65 84.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.852 178.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -65.69 -42.66 90.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.68 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -57.5 -48.05 80.27 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.45 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.2 OUTLIER -58.91 -46.58 87.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.348 -178.872 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.96 -44.74 96.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.393 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -64.31 -40.53 96.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.712 -177.077 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -69.9 -41.97 73.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.507 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.467 HD21 ' CZ ' ' A' ' 200' ' ' PHE . 78.2 mt -77.93 -6.89 55.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.104 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 72.27 32.17 62.92 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.043 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 525' ' ' TYR . . . . . 0.711 ' HB2' ' HD3' ' B' ' 498' ' ' ARG . 64.4 t80 -103.42 88.5 3.12 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -82.45 46.02 1.01 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.216 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 64.2 20.06 12.03 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.275 -176.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 30.6 p . . . . . 0 C--O 1.247 0.968 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.545 179.876 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 121.399 0.618 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 25.8 p-10 -125.55 -37.87 2.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.129 179.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -136.94 -36.12 0.69 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.747 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 156.45 177.68 29.84 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 m 62.06 84.87 0.13 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.297 0.57 . . . . 0.0 110.83 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -124.15 164.9 18.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.394 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -71.55 -71.65 0.26 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.075 0.464 . . . . 0.0 110.905 -177.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -108.93 -33.41 6.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.955 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 161.67 -147.07 13.03 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.821 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -169.46 12.29 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.937 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -143.76 -74.8 0.26 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.884 0.342 . . . . 0.0 111.076 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 24.0 m -131.43 101.62 15.87 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.396 -178.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.92 -62.79 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.795 2.33 . . . . 0.0 111.868 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 30.1 m -115.54 141.34 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.436 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -115.47 26.85 9.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.521 0.677 . . . . 0.0 109.712 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.61 -1.15 32.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.548 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 50.7 mt 72.91 146.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.754 0.659 . . . . 0.0 111.297 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -105.47 -62.37 1.37 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.331 176.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 16.0 m -154.11 101.19 2.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.09 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 24.5 Cg_exo -63.85 152.15 81.99 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.433 2.089 . . . . 0.0 111.112 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -131.38 150.56 52.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.894 0.378 . . . . 0.0 111.399 -175.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.71 144.5 9.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.383 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.78 -47.96 17.72 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 112.104 -173.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt 71.57 -38.64 0.43 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.19 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -65.31 -26.15 67.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.571 0.7 . . . . 0.0 109.195 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -55.93 -24.27 36.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.312 174.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.601 HD11 HD21 ' B' ' 504' ' ' LEU . 75.4 mt -75.47 154.61 36.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.237 0.541 . . . . 0.0 111.275 -176.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -63.66 142.58 58.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.695 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 155' ' ' VAL . . . . . 0.59 ' HB ' ' HD3' ' A' ' 175' ' ' LYS . 5.1 p -58.4 -31.67 43.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.875 0.369 . . . . 0.0 110.577 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.32 -38.98 88.95 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.542 175.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.629 HG21 ' HG2' ' B' ' 500' ' ' GLU . 39.0 m -67.92 -40.07 83.44 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 75.0 mt -63.85 -44.47 93.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.332 0.587 . . . . 0.0 110.006 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -62.59 -33.66 75.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.169 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.643 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 28.4 ttm180 -67.11 -43.67 81.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.078 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 161' ' ' TYR . . . . . 0.519 ' HA ' HG13 ' B' ' 495' ' ' VAL . 69.7 t80 -54.88 -56.31 20.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.838 174.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -67.23 -31.84 72.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.433 -174.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -73.06 -43.42 61.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.705 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 65.9 t-80 -66.91 -41.67 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.546 -178.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.98 -4.36 52.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.135 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 56.84 56.65 5.26 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.22 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 88.9 mt -88.57 124.04 66.74 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.339 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.85 127.71 24.36 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.749 2.3 . . . . 0.0 111.548 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.57 ' HB ' HD11 ' A' ' 173' ' ' LEU . 1.3 p -138.97 159.03 43.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.089 0.471 . . . . 0.0 112.135 -175.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -96.04 149.84 36.48 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.01 176.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.23 145.24 71.72 Favored 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.757 2.305 . . . . 0.0 112.29 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.89 46.94 4.35 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.231 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 173' ' ' LEU . . . . . 0.57 HD11 ' HB ' ' A' ' 169' ' ' THR . 99.1 mt -85.7 146.11 26.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.223 0.535 . . . . 0.0 111.855 -177.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.549 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 19.7 t-20 -108.15 159.36 16.66 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.725 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.59 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.8 tptm -49.17 -49.27 43.34 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 122.765 0.426 . . . . 0.0 111.143 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.8 -39.92 91.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.101 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -60.27 -39.58 87.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.125 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.556 ' CD1' HG23 ' A' ' 155' ' ' VAL . 86.3 mt -59.21 -54.68 44.18 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.051 176.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.5 t -56.93 -40.82 74.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 123.833 0.708 . . . . 0.0 111.296 -176.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.7 -50.92 71.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.722 0.296 . . . . 0.0 110.874 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -65.59 -42.88 93.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.588 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 78.9 t -58.38 -49.29 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.35 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.02 94.11 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.575 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -59.42 -45.65 90.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.932 0.396 . . . . 0.0 110.684 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 -83.69 -22.92 31.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.451 . . . . 0.0 110.618 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.588 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.0 t80 -65.47 -41.79 92.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.747 -178.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -71.63 -11.36 60.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.411 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 4.9 p -116.46 22.91 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.916 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 78.2 mt -75.59 125.4 88.63 Favored Pre-proline 0 C--O 1.236 0.359 0 CA-C-O 120.58 0.229 . . . . 0.0 110.456 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 190' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 12.6 Cg_exo -70.18 126.41 13.0 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.992 2.461 . . . . 0.0 110.963 174.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 3.8 p -147.21 155.26 11.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.94 -175.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -136.09 133.03 36.88 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.271 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.63 -64.67 0.74 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -55.91 -53.61 54.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.434 -171.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.99 -43.94 97.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.743 0.306 . . . . 0.0 111.822 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 33.3 m -68.61 -43.14 77.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.237 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.13 -49.91 76.08 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 24.9 m -57.85 -46.69 84.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.864 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.38 -49.64 76.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.772 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.535 ' CD1' HD22 ' B' ' 488' ' ' LEU . 61.2 t80 -61.93 -54.77 37.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.215 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.402 ' HA ' ' HZ ' ' B' ' 522' ' ' PHE . 73.6 mt -58.08 -46.05 88.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.198 0.523 . . . . 0.0 110.872 -177.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.58 -40.27 96.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.152 -176.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 16.5 m -70.67 -54.61 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.124 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 43.8 t -61.47 -35.59 67.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -73.12 -17.6 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -92.42 -49.63 6.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.729 0.3 . . . . 0.0 110.973 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -169.87 159.82 8.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.278 0.561 . . . . 0.0 109.643 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 11.7 mptt -87.43 137.62 32.18 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.692 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 209' ' ' ASN . . . . . 0.521 HD22 ' N ' ' A' ' 209' ' ' ASN . 0.1 OUTLIER -52.53 162.52 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.448 0.906 . . . . 0.0 113.448 -174.11 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -128.25 -162.78 1.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.386 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 18.8 m 70.65 11.06 7.22 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.535 0.522 . . . . 0.0 111.199 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -97.71 -47.57 5.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.151 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 54.4 tp -139.16 136.21 34.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.773 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 214' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 214' ' ' LYS . 0.3 OUTLIER -108.9 140.3 42.56 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.583 -179.429 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.7 -169.25 1.47 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.544 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 63.97 27.98 14.37 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.0 m -122.17 14.95 10.61 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 101.95 95.03 2.25 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.899 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 12.3 p -142.47 143.96 25.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.697 0.284 . . . . 0.0 110.578 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 8.1 p80 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.136 178.784 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 121.219 0.533 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -104.74 -49.45 3.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -109.43 162.26 14.53 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.577 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 15.2 m -63.65 133.28 53.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -82.8 -70.86 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.817 0.342 . . . . 0.0 110.671 -177.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -155.11 10.24 0.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.429 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 116.64 -65.14 0.33 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 42.9 t -75.04 123.14 30.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -165.9 -51.62 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.984 -0.627 . . . . 0.0 111.858 178.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.5 t -69.32 -16.06 63.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.48 0.181 . . . . 0.0 110.834 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -60.4 3.56 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.79 175.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 39.1 m -65.28 -26.67 68.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.88 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.71 -52.74 59.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.049 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.507 ' O ' HG23 ' B' ' 471' ' ' VAL . 63.7 t80 -54.88 -58.81 6.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.614 176.853 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -65.01 -27.63 68.96 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -172.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -71.36 -42.13 68.86 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.957 0.408 . . . . 0.0 109.992 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -61.51 -45.49 93.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.191 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.528 HG13 HD21 ' B' ' 509' ' ' LEU . 84.8 t -55.95 -47.66 79.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.797 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -59.41 -40.58 87.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.433 -178.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -79.41 -35.02 41.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.728 0.299 . . . . 0.0 111.198 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -70.91 -46.72 62.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 50.7 mt -61.04 -43.55 98.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.494 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 476' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' B' ' 476' ' ' ARG . 25.6 ttt180 70.68 -61.2 0.48 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.154 0.909 . . . . 0.0 112.326 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.8 t -62.87 145.19 55.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.719 -176.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.44 -50.84 63.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.627 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.61 -24.4 64.57 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.359 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.602 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.88 -56.08 15.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.053 0.454 . . . . 0.0 110.186 177.077 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.409 ' CE2' HD11 ' B' ' 485' ' ' LEU . 62.4 t80 -66.74 -37.16 84.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.255 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 34.2 tt0 -63.99 -45.87 87.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.438 179.053 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -60.39 -39.84 88.75 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 67.5 t80 -55.57 -49.91 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.135 174.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.409 HD11 ' CE2' ' B' ' 481' ' ' TYR . 88.6 mt -65.06 -33.97 77.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.188 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.916 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 26.1 mtt180 -64.85 -41.3 95.81 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.893 0.377 . . . . 0.0 110.277 177.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 61.4 m -60.87 -34.73 75.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.979 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.535 HD22 ' CD1' ' A' ' 200' ' ' PHE . 44.3 mt -66.99 -52.41 42.98 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.086 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 489' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' B' ' 486' ' ' ARG . 10.8 m -59.6 -42.24 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -177.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.577 ' HA ' ' HG2' ' B' ' 493' ' ' GLN . 17.1 pt -70.47 -32.31 49.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.146 -0.622 . . . . 0.0 111.132 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -64.97 -45.7 84.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.196 0.522 . . . . 0.0 110.176 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -63.94 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.029 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 493' ' ' GLN . . . . . 0.851 ' HG3' HG23 ' B' ' 495' ' ' VAL . 21.3 pt20 -93.68 13.3 22.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.303 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 67.6 35.59 4.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.308 173.505 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.851 HG23 ' HG3' ' B' ' 493' ' ' GLN . 64.8 t -88.8 -52.91 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.029 0.443 . . . . 0.0 110.061 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.422 HG12 HG13 ' B' ' 490' ' ' ILE . 49.5 pt -110.08 145.02 17.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.125 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 497' ' ' SER . . . . . 0.443 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.2 t -84.93 178.49 7.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.981 0.419 . . . . 0.0 110.385 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.59 ' O ' HG23 ' B' ' 502' ' ' VAL . 9.5 ttp180 -55.38 -47.7 75.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.251 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.09 -53.11 62.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.162 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 500' ' ' GLU . . . . . 0.629 ' HG2' HG21 ' A' ' 157' ' ' THR . 1.9 mp0 -56.6 -40.31 75.09 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.795 HD23 HD21 ' B' ' 523' ' ' LEU . 67.8 tp -60.03 -49.39 77.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 110.939 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 498' ' ' ARG . 8.1 t -68.06 -30.32 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.41 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.47 -46.08 70.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.344 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.601 HD21 HD11 ' A' ' 153' ' ' LEU . 86.4 mt -62.37 -40.31 96.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.988 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -87.23 6.78 2.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.084 0.468 . . . . 0.0 111.194 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.654 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 40.3 t -56.19 -52.98 68.59 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.733 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.3 Cg_exo -66.58 -7.94 19.5 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.055 1.837 . . . . 0.0 113.056 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.473 ' O ' ' HD3' ' B' ' 511' ' ' LYS . 96.5 m-85 -100.15 -50.18 4.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.516 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.528 HD21 HG13 ' B' ' 471' ' ' VAL . 86.9 mt -106.6 -8.45 16.96 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.392 -177.241 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.44 -20.17 69.42 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.269 -176.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' B' ' 508' ' ' PHE . 0.0 OUTLIER -83.05 -5.11 58.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.745 0.307 . . . . 0.0 110.652 177.797 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.433 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 58.7 m-85 -118.71 93.23 45.79 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 513' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 9.4 Cg_endo -51.8 -54.23 5.66 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.483 2.788 . . . . 0.0 113.673 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -65.1 -44.57 88.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.303 0.573 . . . . 0.0 110.429 -176.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.64 -42.72 98.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.797 -176.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -72.09 -31.98 66.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.691 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -70.26 -34.69 73.12 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.506 177.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -60.25 -49.22 78.47 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.664 ' O ' HD12 ' B' ' 523' ' ' LEU . 33.1 t80 -54.98 -53.53 54.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.506 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -56.17 -40.94 74.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.784 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -63.46 -35.94 82.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.978 0.418 . . . . 0.0 110.459 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 522' ' ' PHE . . . . . 0.402 ' HZ ' ' HA ' ' A' ' 201' ' ' ILE . 60.7 t80 -65.07 -41.4 95.13 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.653 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.795 HD21 HD23 ' B' ' 501' ' ' LEU . 3.6 mp -76.98 -15.35 59.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.205 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.62 34.06 63.27 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -171.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -97.8 106.62 18.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.013 -0.593 . . . . 0.0 110.494 -174.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 526' ' ' LYS . . . . . 0.484 ' HG2' ' OXT' ' B' ' 528' ' ' SER . 8.9 ptpp? -100.88 39.88 1.34 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.422 -178.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 70.87 8.0 6.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.497 -169.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 528' ' ' SER . . . . . 0.484 ' OXT' ' HG2' ' B' ' 526' ' ' LYS . 32.6 t . . . . . 0 C--O 1.247 0.958 0 CA-C-N 114.576 -1.193 . . . . 0.0 108.187 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.477 0.92 0 CA-C-O 120.767 0.317 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -114.42 123.33 49.17 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -82.61 -2.42 53.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.878 0.371 . . . . 0.0 111.584 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 114.5 30.97 2.27 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.458 178.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.6 t -137.45 144.49 42.33 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -119.7 -41.55 2.68 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.062 0.458 . . . . 0.0 110.81 -178.128 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -119.72 -176.22 3.12 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.16 -52.38 65.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.709 0.29 . . . . 0.0 111.531 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 161.94 40.47 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.067 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 74.06 -115.21 4.83 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.51 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -97.2 149.24 22.23 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.004 0.431 . . . . 0.0 110.603 -178.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' SER . . . . . 0.473 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 50.0 m -103.86 128.4 27.35 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.443 179.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 139' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 21.9 Cg_exo -65.27 -34.66 44.1 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.782 2.321 . . . . 0.0 111.91 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.0 m -97.94 107.9 20.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.371 0.605 . . . . 0.0 111.064 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -112.57 96.32 5.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.018 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -103.97 125.5 50.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.432 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -152.64 113.95 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.384 -177.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' B' ' 477' ' ' SER . 8.0 t70 -62.6 -65.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 170.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.5 m -154.24 105.7 2.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.42 178.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 146' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 19.3 Cg_exo -63.47 148.1 92.81 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.069 1.846 . . . . 0.0 110.888 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -106.32 158.42 16.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.828 0.347 . . . . 0.0 111.038 -173.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.4 p -110.22 131.79 60.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.412 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -87.92 124.88 34.14 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 88.6 mt -110.17 5.97 22.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -94.01 -15.93 24.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -73.48 -19.5 60.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.397 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' LEU . . . . . 0.46 HD11 HD21 ' B' ' 504' ' ' LEU . 72.5 mt -71.41 156.52 39.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 111.39 -177.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -69.98 158.75 35.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.365 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.51 -41.4 92.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.81 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -64.98 -39.78 93.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.507 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 157' ' ' THR . . . . . 0.432 ' CG2' HG22 ' B' ' 496' ' ' ILE . 25.0 m -57.36 -47.91 80.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.096 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.35 -41.86 96.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.684 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -65.98 -33.52 75.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.623 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 160' ' ' ARG . . . . . 0.472 ' HD3' ' O ' ' B' ' 495' ' ' VAL . 17.9 ttt85 -67.29 -44.4 79.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.212 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -53.47 -49.98 66.3 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.444 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' LYS . . . . . 0.599 ' HE2' HG21 ' A' ' 169' ' ' THR . 9.1 mtpm? -56.9 -42.17 79.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.802 -179.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -72.94 -47.65 43.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.602 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -71.79 -31.58 66.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 165' ' ' PHE . . . . . 0.426 ' CE1' HG22 ' B' ' 490' ' ' ILE . 32.3 m-85 -93.29 1.96 56.78 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.064 178.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 58.2 73.95 0.45 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.448 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.421 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 92.4 mt -114.73 107.66 50.28 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.415 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 168' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 37.5 Cg_endo -67.01 126.2 14.82 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.404 2.069 . . . . 0.0 111.419 178.484 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' THR . . . . . 0.599 HG21 ' HE2' ' A' ' 162' ' ' LYS . 15.0 p -136.55 165.26 26.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.266 -175.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 170' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 170' ' ' ARG . 47.8 mtt180 -99.61 149.04 35.53 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.401 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.53 137.33 73.12 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.849 2.366 . . . . 0.0 112.245 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 110.26 36.54 1.94 Allowed Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -177.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.36 144.38 27.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.135 0.493 . . . . 0.0 111.386 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' ASN . . . . . 0.631 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 59.4 m-80 -136.18 177.05 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.689 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 175' ' ' LYS . . . . . 0.581 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.9 tptm -53.03 -56.07 18.91 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.405 0.44 . . . . 0.0 111.791 -176.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -59.67 -35.5 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.182 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 177' ' ' GLN . . . . . 0.413 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 14.6 mm-40 -66.63 -46.83 74.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.271 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 178' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 69.7 mt -60.04 -48.02 83.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 179' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 175' ' ' LYS . 49.0 t -58.27 -43.33 85.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.943 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -45.94 91.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.581 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 72.5 mt -66.43 -47.64 83.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 CA-C-O 120.994 0.426 . . . . 0.0 110.616 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 182' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 74.1 t -59.87 -49.58 83.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.499 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.53 -40.49 98.78 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.412 -0.423 . . . . 0.0 112.255 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 44.2 t -54.91 -48.55 72.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.807 0.337 . . . . 0.0 110.947 178.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -83.64 -24.95 31.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -177.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 186' ' ' PHE . . . . . 0.508 ' HE1' HD13 ' B' ' 490' ' ' ILE . 39.1 t80 -64.72 -39.43 93.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 122.87 0.468 . . . . 0.0 110.963 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -74.75 5.53 4.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.682 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.4 p -133.43 24.02 4.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.659 0.266 . . . . 0.0 111.477 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 189' ' ' ILE . . . . . 0.587 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.4 mt -86.73 117.69 69.03 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.612 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.66 122.59 9.78 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.808 2.339 . . . . 0.0 111.168 175.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 191' ' ' VAL . . . . . 0.574 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.4 p -134.5 147.36 29.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.906 0.384 . . . . 0.0 110.97 -175.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -118.04 118.47 32.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.142 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 193' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 86.8 tt0 -48.78 -58.78 4.26 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 0.0 112.633 -173.458 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 194' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 194' ' ' LYS . 0.5 OUTLIER -64.68 -49.18 71.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.497 0.189 . . . . 0.0 111.166 -173.368 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.0 -46.51 84.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.792 0.329 . . . . 0.0 111.369 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.5 m -63.03 -41.28 99.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.43 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 197' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 59.1 mt -60.42 -46.37 90.24 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 175.057 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 47.2 m -58.61 -46.68 86.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.732 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 66.1 m -57.05 -54.61 44.84 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.545 177.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 200' ' ' PHE . . . . . 0.517 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.7 t80 -56.56 -53.11 61.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.348 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 197' ' ' LEU . 74.7 mt -55.85 -52.09 52.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.484 -175.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -70.51 -25.94 63.36 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.2 m -72.17 -46.36 56.67 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.706 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 204' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 200' ' ' PHE . 22.0 t -76.2 -35.33 27.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.204 -175.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 205' ' ' ARG . . . . . 0.568 ' HD2' ' OE2' ' B' ' 464' ' ' GLU . 17.9 mtp180 -64.94 -44.76 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.068 178.036 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -95.04 80.98 3.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.544 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 13.4 t70 67.47 124.31 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.53 0.732 . . . . 0.0 111.205 -176.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 208' ' ' LYS . . . . . 0.62 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 0.3 OUTLIER -87.77 22.07 2.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.251 -170.183 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 65.03 91.5 0.08 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.302 0.573 . . . . 0.0 110.494 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.35 85.02 2.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.182 -177.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 4.8 p -73.76 -30.8 63.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.541 173.303 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 73.53 -36.28 0.34 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.854 172.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 83.7 mt 60.49 94.66 0.04 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.53 0.681 . . . . 0.0 110.831 -177.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -126.16 -0.37 7.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.05 -175.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -91.23 82.62 5.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 110.982 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -110.1 -19.79 12.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.378 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 31.2 t -108.31 137.24 46.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.003 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 172.51 -19.32 0.06 OUTLIER Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.858 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.76 150.56 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 O-C-N 122.535 -0.391 . . . . 0.0 111.358 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.724 -0.655 . . . . 0.0 109.554 179.378 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.804 0.335 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -71.75 -48.35 47.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.342 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -86.21 154.79 21.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.479 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 20.4 t -117.88 160.17 21.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.092 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -97.64 -51.64 4.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.881 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -135.22 2.35 3.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.675 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 77.44 -52.28 3.43 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.076 -176.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 40.8 t -76.39 136.67 24.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 131.01 38.25 0.29 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.815 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 26.4 p -81.16 3.65 22.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.715 0.293 . . . . 0.0 110.947 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 464' ' ' GLU . . . . . 0.568 ' OE2' ' HD2' ' A' ' 205' ' ' ARG . 1.7 mp0 -54.98 -44.45 74.46 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 175.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.0 t -60.5 -40.35 91.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.023 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 466' ' ' LEU . . . . . 0.535 HD21 ' HE3' ' B' ' 470' ' ' LYS . 8.9 tt -62.14 -49.33 76.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.798 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 467' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.5 t80 -54.16 -58.04 8.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.721 176.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 468' ' ' PHE . . . . . 0.4 ' HE1' ' HZ ' ' B' ' 484' ' ' PHE . 46.1 m-85 -64.54 -29.59 70.62 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -174.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.01 -45.04 78.75 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 470' ' ' LYS . . . . . 0.535 ' HE3' HD21 ' B' ' 466' ' ' LEU . 89.8 mttt -64.31 -40.14 95.32 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.701 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 471' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.1 t -59.79 -42.19 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.499 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.49 -46.36 83.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.921 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -75.67 -34.35 60.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.375 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 474' ' ' ALA . . . . . 0.43 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -69.75 -53.8 16.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.967 -175.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.46 -33.98 76.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.207 -176.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 69.2 -59.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.962 0.789 . . . . 0.0 112.04 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 477' ' ' SER . . . . . 0.577 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.5 t -62.52 126.68 28.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.057 0.456 . . . . 0.0 111.261 -178.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.07 -30.36 70.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.023 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -72.79 -40.71 65.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.924 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 480' ' ' ALA . . . . . 0.486 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.46 -43.41 97.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.468 176.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 481' ' ' TYR . . . . . 0.469 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 47.2 t80 -66.53 -38.53 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.081 178.043 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 482' ' ' GLU . . . . . 0.515 ' HG3' ' CG1' ' A' ' 191' ' ' VAL . 37.8 tt0 -60.62 -40.48 92.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.204 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.43 -42.52 99.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 484' ' ' PHE . . . . . 0.4 ' HZ ' ' HE1' ' B' ' 468' ' ' PHE . 46.6 t80 -55.74 -42.61 75.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.384 172.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 485' ' ' LEU . . . . . 0.574 ' HB3' HG21 ' A' ' 191' ' ' VAL . 92.1 mt -66.99 -32.97 74.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 486' ' ' ARG . . . . . 0.587 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.2 OUTLIER -59.68 -43.24 94.08 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.113 0.482 . . . . 0.0 110.059 172.591 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.4 m -60.84 -35.67 77.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.155 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 488' ' ' LEU . . . . . 0.517 HD22 ' CD1' ' A' ' 200' ' ' PHE . 41.9 mt -68.52 -46.17 70.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.586 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.9 m -65.34 -42.06 92.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.555 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 490' ' ' ILE . . . . . 0.508 HD13 ' HE1' ' A' ' 186' ' ' PHE . 11.3 pt -69.98 -29.64 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.926 178.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -68.23 -42.4 79.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.225 0.536 . . . . 0.0 109.789 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -59.24 -41.29 88.41 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.126 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -89.01 18.02 5.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.169 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 54.28 48.19 21.35 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.765 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 495' ' ' VAL . . . . . 0.472 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 83.2 t -98.21 -42.45 11.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.85 175.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 496' ' ' ILE . . . . . 0.432 HG22 ' CG2' ' A' ' 157' ' ' THR . 41.7 pt -115.82 151.23 17.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.695 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 78.2 p -89.84 177.29 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.624 0.249 . . . . 0.0 110.5 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 498' ' ' ARG . . . . . 0.62 ' HD3' ' HB3' ' A' ' 208' ' ' LYS . 22.9 mtm180 -52.38 -54.17 35.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.449 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.66 -48.48 77.5 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.49 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.13 -39.81 75.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.722 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 501' ' ' LEU . . . . . 0.573 HD23 HD21 ' B' ' 523' ' ' LEU . 53.7 tp -62.95 -47.4 83.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 502' ' ' VAL . . . . . 0.502 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.2 OUTLIER -64.62 -31.3 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.266 0.555 . . . . 0.0 109.923 -179.629 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -67.26 -45.86 75.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.604 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 504' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 153' ' ' LEU . 77.9 mt -64.2 -41.53 97.03 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 505' ' ' VAL . . . . . 0.412 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.3 p -85.37 3.8 3.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.931 0.396 . . . . 0.0 111.113 -178.145 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 506' ' ' SER . . . . . 0.597 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 22.9 t -55.7 -51.54 79.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.057 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 507' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 50.4 Cg_exo -57.03 -35.04 98.78 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.877 1.718 . . . . 0.0 112.486 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 508' ' ' PHE . . . . . 0.406 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 83.4 m-85 -73.74 -40.86 63.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.27 -174.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 509' ' ' LEU . . . . . 0.412 ' HG ' HG22 ' B' ' 505' ' ' VAL . 81.2 mt -101.95 4.71 40.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.82 0.343 . . . . 0.0 111.242 -176.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.48 -18.41 69.75 Favored Glycine 0 N--CA 1.455 -0.068 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.766 -177.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 511' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' B' ' 511' ' ' LYS . 2.6 mptp? -93.78 -4.71 49.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.076 0.465 . . . . 0.0 109.79 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 512' ' ' PHE . . . . . 0.43 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 43.7 m-85 -129.56 87.28 53.35 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.644 -172.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.55 -43.45 58.84 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.229 2.619 . . . . 0.0 113.18 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.69 -44.4 96.58 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.133 0.492 . . . . 0.0 110.709 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 515' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 515' ' ' LEU . 1.4 tp -69.28 -46.61 66.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.423 -173.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 516' ' ' PHE . . . . . 0.511 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 44.5 t80 -66.78 -36.38 82.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.907 0.384 . . . . 0.0 110.623 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.69 -41.55 75.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.545 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 518' ' ' TRP . . . . . 0.439 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 29.3 t90 -55.14 -48.21 74.02 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 175.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 519' ' ' PHE . . . . . 0.567 ' O ' HD13 ' B' ' 523' ' ' LEU . 19.0 t80 -56.99 -46.96 81.87 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.622 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 520' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 83.1 mttt -56.33 -50.42 71.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.259 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.14 -32.81 74.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.452 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -69.15 -44.12 72.96 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.369 0.604 . . . . 0.0 109.5 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 523' ' ' LEU . . . . . 0.573 HD21 HD23 ' B' ' 501' ' ' LEU . 9.7 mp -73.95 -19.72 60.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.674 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.23 13.99 69.94 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -82.98 118.51 23.55 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.186 0.517 . . . . 0.0 110.455 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -134.02 40.51 3.06 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.659 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 58.1 28.46 16.42 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.565 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.723 -0.655 . . . . 0.0 110.177 -175.839 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.915 0.388 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -59.02 132.79 49.36 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.546 2.164 . . . . 0.0 111.737 -178.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -102.72 138.23 39.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.239 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.68 125.3 40.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.297 0.57 . . . . 0.0 111.277 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 19.5 t0 -81.81 114.38 20.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.589 174.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.73 HD23 HD11 ' B' ' 504' ' ' LEU . 56.3 mt -100.01 -0.45 39.22 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.335 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -82.66 -19.36 38.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.503 -179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' B' ' 504' ' ' LEU . 28.8 pt20 -71.01 -26.8 63.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.847 178.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.552 HD21 HD13 ' B' ' 504' ' ' LEU . 86.5 mt -65.25 149.21 50.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.687 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -65.73 152.53 44.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.223 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.472 HG22 ' HD3' ' A' ' 175' ' ' LYS . 57.6 t -55.93 -40.1 60.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.309 0.576 . . . . 0.0 109.796 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.84 -39.04 93.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.527 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.404 HG23 ' HA ' ' B' ' 496' ' ' ILE . 23.0 m -64.21 -44.77 90.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.14 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.07 -41.7 90.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.15 0.5 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.63 -32.39 73.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.418 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.593 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.2 ttm180 -67.47 -44.46 78.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.013 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -51.5 -49.58 61.59 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.063 0.458 . . . . 0.0 110.224 172.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.419 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.4 mtpm? -63.52 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.884 -178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -79.89 -39.14 31.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.636 0.255 . . . . 0.0 111.328 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -77.87 -32.82 52.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.96 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -91.06 -4.95 55.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.971 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.8 mptt 56.67 81.78 0.13 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.539 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.43 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 90.3 mt -116.8 95.36 46.33 Favored Pre-proline 0 C--N 1.325 -0.466 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 21.0 Cg_endo -61.73 127.27 21.1 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.798 2.332 . . . . 0.0 111.405 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.412 HG21 ' CE ' ' A' ' 162' ' ' LYS . 10.8 p . . . . . 0 C--N 1.319 -0.738 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.221 -174.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.4 mt . . . . . 0 C--O 1.234 0.284 0 CA-C-O 120.948 0.404 . . . . 0.0 111.297 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.58 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 13.9 m120 -121.42 174.96 6.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.258 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.632 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.7 tptm -54.88 -53.1 59.8 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.473 0.483 . . . . 0.0 111.371 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.38 -39.01 85.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.675 0.274 . . . . 0.0 111.196 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -62.12 -46.29 89.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.271 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 84.7 mt -59.05 -49.68 76.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 175' ' ' LYS . 39.0 t -58.73 -40.54 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.344 -176.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -64.72 -49.17 71.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.929 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.32 -47.82 88.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.821 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.24 -47.71 89.4 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.177 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . 0.5 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -62.45 -38.96 97.18 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.671 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.46 -41.94 99.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -81.04 -31.6 34.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.651 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.98 -27.87 69.13 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 122.87 0.468 . . . . 0.0 110.922 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 63.5 mttp -72.8 -6.71 46.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.34 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.9 t -133.09 60.74 1.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 110.704 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.974 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 68.8 mt -110.75 119.0 47.37 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.169 175.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.01 129.24 19.12 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.074 2.516 . . . . 0.0 111.214 175.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.0 p -142.45 154.65 18.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.696 -173.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.42 122.01 21.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.638 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 29.0 tt0 -48.79 -64.13 0.89 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.413 0.445 . . . . 0.0 112.146 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -56.86 -53.04 62.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -172.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -66.88 -42.13 86.09 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.712 -176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.7 m -64.92 -40.79 95.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.978 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 52.5 mt -63.38 -43.9 96.29 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 53.9 m -58.58 -48.99 79.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.097 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 74.7 m -58.36 -48.73 79.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.863 0.364 . . . . 0.0 110.704 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.532 ' CD1' HD22 ' B' ' 488' ' ' LEU . 42.2 t80 -57.33 -55.65 32.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.079 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.544 HD11 ' HE2' ' B' ' 468' ' ' PHE . 85.4 mt -57.64 -45.48 86.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.243 0.544 . . . . 0.0 110.57 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.88 -59.83 4.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.191 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 68.8 m -62.36 -45.4 93.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -174.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.537 HG11 HD23 ' B' ' 523' ' ' LEU . 51.6 t -67.39 -35.32 73.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.37 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 . . . . . 0 C--N 1.328 -0.342 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.109 178.097 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 11.6 t . . . . . 0 N--CA 1.454 -0.261 0 CA-C-O 121.13 0.491 . . . . 0.0 110.398 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -66.6 -44.0 83.29 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 176.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 10.7 t -65.24 -33.28 75.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' B' ' 463' ' ' THR . 53.9 tp -60.73 -49.22 78.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.992 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 471' ' ' VAL . 78.1 t80 -55.78 -51.74 66.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.364 176.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.544 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.7 m-85 -65.45 -34.97 79.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.535 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.62 -45.44 94.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -58.85 -48.75 80.26 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.812 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 467' ' ' PHE . 63.3 t -58.92 -47.07 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.875 0.369 . . . . 0.0 110.658 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -39.37 90.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -79.85 -30.77 40.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.196 -175.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.457 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -80.0 -47.69 14.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.611 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 508' ' ' PHE . 24.9 mt -66.53 -40.39 89.11 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.371 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 71.25 -46.05 0.63 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.525 0.73 . . . . 0.0 112.692 173.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 33.8 t -72.13 136.68 46.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.671 0.272 . . . . 0.0 110.493 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.82 97.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.823 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.55 -29.65 64.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.475 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -68.34 -42.38 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.408 . . . . 0.0 110.425 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -67.48 -37.36 82.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 44.6 tt0 -60.26 -42.1 94.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 174.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.475 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 19.5 t-20 -53.59 -49.16 68.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.277 176.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -54.07 -47.69 71.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.29 0.567 . . . . 0.0 110.507 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.01 -31.62 72.29 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.134 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.974 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 17.1 mtt85 -67.49 -37.55 83.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.39 . . . . 0.0 110.258 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.4 m -62.17 -36.37 81.67 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.4 mt -66.46 -47.43 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.287 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.538 HG22 ' HA ' ' B' ' 486' ' ' ARG . 12.6 m -64.7 -42.45 95.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.756 -0.377 . . . . 0.0 111.902 -177.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.422 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 26.1 pt -69.22 -31.27 49.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.988 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -63.96 -45.74 87.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -64.49 -35.94 82.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -81.92 17.57 1.52 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.693 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 64.22 29.54 13.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 111.064 172.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.593 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 95.8 t -93.33 -55.12 6.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.377 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.404 ' HA ' HG23 ' A' ' 157' ' ' THR . 41.3 pt -104.35 149.49 8.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.802 -0.359 . . . . 0.0 111.194 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.43 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.1 m -78.64 173.77 12.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.512 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -57.78 -58.82 6.7 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.219 0.533 . . . . 0.0 111.076 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . 0.661 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -60.81 -38.04 84.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.933 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 7.9 mm-40 -56.4 -38.3 71.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.195 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.9 tp -64.84 -52.46 56.56 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.942 177.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -62.72 -40.66 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.929 -178.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -67.48 -37.74 83.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.422 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.73 HD11 HD23 ' A' ' 150' ' ' LEU . 10.7 tp -62.37 -41.78 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.746 0.308 . . . . 0.0 111.181 -174.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 18.0 m -86.11 14.24 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.855 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 48.3 t -57.53 -51.41 81.91 Favored Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 178.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.1 Cg_exo -61.38 -8.42 10.58 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.137 1.891 . . . . 0.0 112.738 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.442 ' HB3' HD21 ' B' ' 475' ' ' LEU . 88.2 m-85 -106.58 -61.5 1.52 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.302 -177.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.49 HD21 HG13 ' B' ' 471' ' ' VAL . 46.4 mt -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.364 -173.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.62 68.43 Favored Glycine 0 N--CA 1.454 -0.118 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.744 -176.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.29 0.567 . . . . 0.0 110.185 178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.477 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 45.7 m-85 -115.76 98.11 50.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.244 -175.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.8 Cg_endo -54.17 -46.36 34.16 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.398 2.732 . . . . 0.0 113.211 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -61.81 -38.5 88.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.175 0.512 . . . . 0.0 110.892 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 33.3 tp -74.48 -47.09 35.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.546 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 11.8 t80 -69.36 -32.22 71.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.738 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -70.14 -40.32 74.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.226 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -54.84 -48.36 72.98 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.609 ' O ' ' HG ' ' B' ' 523' ' ' LEU . 8.4 t80 -56.79 -49.71 74.53 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.652 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.604 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 94.8 mttt -59.01 -44.74 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.529 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -64.14 -35.24 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.812 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -71.79 -38.9 70.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.569 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' B' ' 519' ' ' PHE . 68.0 mt -77.1 -13.45 59.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.221 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 70.36 43.46 62.3 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -173.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 46.5 t80 . . . . . 0 C--N 1.326 -0.426 0 CA-C-O 120.987 0.422 . . . . 0.0 109.998 -177.131 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.0 m . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 120.733 0.301 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' B' ' 508' ' ' PHE . 32.4 Cg_exo -57.07 136.29 75.76 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 111.392 174.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -110.06 166.07 11.23 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.667 -176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.532 HG12 ' ND2' ' B' ' 483' ' ' ASN . 6.8 p -114.01 140.48 34.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.861 176.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 12.5 t70 -106.33 124.52 49.72 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.433 HD13 HG12 ' A' ' 182' ' ' VAL . 61.7 mt -104.05 2.53 32.25 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.393 0.616 . . . . 0.0 110.624 -177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -86.39 -21.92 26.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.758 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.45 HE21 ' HB3' ' B' ' 503' ' ' GLN . 19.0 pt20 -73.34 -17.57 61.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.835 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.466 HD11 HD21 ' B' ' 504' ' ' LEU . 76.2 mt -75.1 173.1 11.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.269 0.557 . . . . 0.0 111.621 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -87.6 144.8 26.5 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.33 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 178' ' ' LEU . 55.3 t -54.08 -42.26 54.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.516 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.69 -35.41 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.145 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.6 m -69.83 -42.02 74.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.767 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 162' ' ' LYS . 74.7 mt -64.56 -40.94 96.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.226 178.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 159' ' ' ARG . 27.9 mtp85 -64.71 -37.42 87.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.594 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 160' ' ' ARG . 35.2 ttm105 -66.25 -38.85 88.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.446 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.487 ' HA ' HG13 ' B' ' 495' ' ' VAL . 60.4 t80 -56.44 -51.52 68.08 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.275 172.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.635 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 7.4 mtpm? -60.97 -35.19 76.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.457 -177.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -76.43 -34.91 58.76 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.929 -176.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -77.16 -42.4 37.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.338 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.43 ' CE1' HG22 ' B' ' 490' ' ' ILE . 58.2 m-85 -89.63 3.01 53.96 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.465 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 54.5 74.57 0.34 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.7 0.625 . . . . 0.0 111.307 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 84.8 mt -111.05 144.56 30.64 Favored Pre-proline 0 C--N 1.328 -0.353 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.093 -177.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.47 162.58 33.26 Favored 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.041 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.5 p . . . . . 0 C--N 1.323 -0.56 0 CA-C-O 120.949 0.404 . . . . 0.0 111.286 179.921 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 75.2 mt . . . . . 0 C--O 1.233 0.219 0 CA-C-O 121.122 0.486 . . . . 0.0 111.337 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.47 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 8.2 t-20 -154.63 -171.67 3.93 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.4 tptm -64.09 -62.1 1.84 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.731 0.241 . . . . 0.0 111.251 -176.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.21 -30.13 64.3 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.701 0.286 . . . . 0.0 111.383 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 8.9 mm-40 -59.02 -55.29 37.1 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.67 0.748 . . . . 0.0 110.393 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.549 ' CD1' HG13 ' A' ' 155' ' ' VAL . 53.4 mt -64.29 -41.56 96.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.661 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.6 t -60.48 -37.92 76.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.773 -178.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.99 -53.26 48.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.874 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.426 HG21 ' HE2' ' A' ' 162' ' ' LYS . 55.3 mt -60.32 -49.33 84.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 121.01 0.433 . . . . 0.0 110.744 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.433 HG12 HD13 ' A' ' 150' ' ' LEU . 77.5 t -59.17 -49.09 84.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.939 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.58 -37.32 94.0 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.439 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 29.1 t -61.97 -42.36 99.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.93 0.395 . . . . 0.0 110.907 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 -87.26 -25.11 24.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.387 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.413 ' CE2' HG11 ' A' ' 148' ' ' VAL . 73.9 t80 -62.22 -43.58 98.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.104 0.478 . . . . 0.0 110.651 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -80.94 8.13 9.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.566 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 3.2 p -125.12 14.18 8.4 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.805 0.336 . . . . 0.0 111.274 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.442 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 75.6 mt -79.58 120.75 81.24 Favored Pre-proline 0 C--O 1.235 0.321 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.55 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.99 115.96 4.49 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.994 2.463 . . . . 0.0 111.294 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.475 HG21 ' HB3' ' B' ' 485' ' ' LEU . 3.8 p -127.89 156.21 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.068 -174.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 18.9 m120 -128.97 138.33 51.89 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.729 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 27.1 tt0 -55.54 -67.28 0.3 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -72.7 -36.47 67.84 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.777 0.322 . . . . 0.0 110.965 -172.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 12.1 t70 -55.25 -49.6 71.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.993 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 90.4 m -75.54 -35.35 60.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.501 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 35.7 mt -58.45 -46.62 86.17 Favored 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.9 m -61.49 -43.53 98.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.0 m -58.08 -50.99 71.54 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.875 0.369 . . . . 0.0 111.013 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.2 t80 -65.1 -47.13 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.574 -175.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 197' ' ' LEU . 77.5 mt -61.95 -45.71 98.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.034 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -66.42 -35.96 81.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.496 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.9 m -62.41 -61.33 2.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 99.4 t -61.91 -39.71 84.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.855 -174.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 . . . . . 0 C--N 1.33 -0.246 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.742 -178.788 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.5 t . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 120.492 0.187 . . . . 0.0 111.329 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -63.59 -53.63 48.59 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -60.67 -33.45 72.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.606 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.32 -50.7 71.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.247 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.464 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.5 t80 -52.62 -51.31 60.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.774 175.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.414 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 60.4 m-85 -65.02 -34.61 78.83 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.53 -38.16 88.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.935 0.398 . . . . 0.0 110.134 176.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -63.95 -47.06 81.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.223 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.489 HG13 HD21 ' B' ' 509' ' ' LEU . 75.2 t -58.74 -45.24 91.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 110.465 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -59.33 -38.06 79.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -79.01 -41.38 29.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.183 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.536 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -67.27 -43.41 81.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.184 -174.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.02 -30.65 69.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.095 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 69.23 -59.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.526 0 O-C-N 123.942 0.776 . . . . 0.0 112.104 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 32.8 t -69.06 135.09 50.26 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.238 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.17 81.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.245 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.27 -39.24 82.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.259 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.419 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.31 -45.85 89.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.104 0.478 . . . . 0.0 110.326 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.43 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 55.3 t80 -66.81 -31.5 72.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.113 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.663 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 33.5 tt0 -65.49 -42.94 91.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.668 176.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.532 ' ND2' HG12 ' A' ' 148' ' ' VAL . 5.5 m-20 -55.67 -46.28 77.58 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.817 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -55.94 -46.79 78.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.475 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.5 mt -67.73 -32.69 73.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -61.3 -41.33 96.8 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 120.815 0.341 . . . . 0.0 110.183 173.381 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.6 m -62.48 -35.49 79.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.224 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.453 HD22 ' CG ' ' A' ' 200' ' ' PHE . 40.2 mt -68.51 -47.19 67.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.435 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.4 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.5 m -65.33 -40.81 89.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.665 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.8 pt -69.44 -32.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.735 178.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -65.18 -42.79 93.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.21 0.529 . . . . 0.0 109.727 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.19 -38.23 82.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.87 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -86.79 15.95 5.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.475 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 60.5 26.34 15.98 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.752 0.421 . . . . 0.0 111.631 177.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 161' ' ' TYR . 53.6 t -77.13 -48.48 24.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.571 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 38.4 pt -113.3 155.58 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.997 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.453 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 81.4 p -96.27 -173.32 2.76 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -54.88 -59.54 4.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.0 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -58.6 -40.51 83.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.962 -173.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.571 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 6.7 mm-40 -59.19 -44.0 92.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.425 0.631 . . . . 0.0 109.908 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.515 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -62.3 -46.07 90.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.226 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -67.2 -32.9 59.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.728 -178.139 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.45 ' HB3' HE21 ' A' ' 152' ' ' GLN . 87.2 mt-30 -71.57 -39.9 70.29 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.466 HD21 HD11 ' A' ' 153' ' ' LEU . 74.9 mt -65.05 -38.73 91.76 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.885 0.374 . . . . 0.0 111.891 -177.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 34.9 m -84.92 11.41 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.583 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.642 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 43.8 t -61.03 -52.21 73.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.865 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 32.2 Cg_exo -63.61 -15.93 51.62 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.898 1.732 . . . . 0.0 112.378 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.442 ' CD2' ' HB2' ' A' ' 146' ' ' PRO . 94.9 m-85 -90.56 -65.73 0.99 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.082 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.489 HD21 HG13 ' B' ' 471' ' ' VAL . 87.9 mt -92.33 -5.13 52.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.438 -173.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.64 -17.1 68.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.431 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -72.57 -21.1 61.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 176.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.536 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 22.6 m-85 -123.28 86.47 51.71 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.682 -176.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.7 -46.49 29.73 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 123.155 2.57 . . . . 0.0 113.185 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -65.07 -37.55 87.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.871 0.367 . . . . 0.0 111.249 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 20.7 tp -70.4 -38.73 74.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.296 0.57 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.601 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 54.0 t80 -65.38 -35.39 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.828 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -70.01 -32.86 71.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.057 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -59.14 -48.85 80.07 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -56.28 -46.7 79.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.522 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.601 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 92.6 mttt -60.64 -41.01 94.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.186 176.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -61.58 -30.56 70.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -75.92 -39.32 56.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.286 0.565 . . . . 0.0 109.928 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.515 HD21 HD23 ' B' ' 501' ' ' LEU . 10.2 mp -80.76 -24.64 38.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.074 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 95.03 30.55 8.24 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.787 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.486 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.451 -0.384 0 N-CA-C 109.916 -0.401 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.05 155.12 57.48 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.187 1.925 . . . . 0.0 111.737 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.29 137.04 51.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.131 0.491 . . . . 0.0 111.714 -172.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.46 133.59 28.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.086 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -87.38 -26.81 23.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.215 0.531 . . . . 0.0 111.109 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 74.6 mt 64.15 13.77 8.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.227 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.14 -16.03 34.53 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.05 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.8 -15.08 60.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.328 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 157' ' ' THR . 81.2 mt -67.44 140.4 57.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.53 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.19 157.83 36.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.797 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 88.7 t -56.16 -44.17 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.855 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -64.31 -36.58 84.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.808 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.415 HG21 HD22 ' A' ' 153' ' ' LEU . 10.4 m -63.58 -46.58 85.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.629 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.462 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 68.5 mt -62.48 -42.73 99.69 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.743 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 66.4 mtp85 -70.08 -28.81 65.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.503 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 33.7 ttm180 -72.34 -44.6 62.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.513 ' HA ' HG13 ' B' ' 495' ' ' VAL . 57.7 t80 -51.98 -51.22 58.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.081 172.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.695 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 19.8 mtpp -65.97 -29.73 70.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.279 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -81.84 -42.67 19.29 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.701 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 -68.39 -32.77 73.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.874 -175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -95.7 0.11 52.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.151 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 57.64 77.53 0.27 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.016 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 77.0 mt -120.67 134.85 24.31 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.78 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.75 155.15 65.23 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.908 2.405 . . . . 0.0 113.114 -173.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.639 ' HB ' HD11 ' A' ' 173' ' ' LEU . 67.8 p . . . . . 0 C--N 1.326 -0.417 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.358 176.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.639 HD11 ' HB ' ' A' ' 169' ' ' THR . 79.6 mt . . . . . 0 CA--C 1.518 -0.272 0 CA-C-O 121.217 0.532 . . . . 0.0 111.008 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.584 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 93.2 m-20 -131.11 172.95 11.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.184 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.594 ' O ' HG23 ' A' ' 179' ' ' VAL . 21.5 tptm -56.39 -53.9 51.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.353 0.408 . . . . 0.0 110.339 176.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . 0.597 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -62.05 -34.21 75.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.423 -178.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.584 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.6 mm100 -67.03 -41.74 86.06 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.032 0.444 . . . . 0.0 110.879 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 88.0 mt -61.22 -47.87 84.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.837 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 175' ' ' LYS . 35.6 t -60.19 -32.61 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.801 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 13.2 mm-40 -61.97 -57.45 11.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 110.691 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.695 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 38.6 mt -61.69 -43.2 96.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.676 -178.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 178' ' ' LEU . 71.8 t -59.64 -49.0 85.35 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.316 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.2 -40.86 99.54 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.314 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 41.2 t -55.85 -42.73 76.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 111.195 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -86.38 -30.49 22.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.873 0.368 . . . . 0.0 111.3 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -63.87 -32.01 73.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.145 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.63 14.64 1.59 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.54 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 43.0 m -147.45 34.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.692 0.282 . . . . 0.0 111.457 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.908 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 72.4 mt -93.31 114.92 64.16 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.752 -0.203 . . . . 0.0 110.613 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.29 127.24 18.69 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.67 2.247 . . . . 0.0 110.892 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 9.0 p -144.61 149.76 16.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.739 -174.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . 0.694 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 12.6 m-80 -112.52 155.42 24.34 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.1 tt0 -71.64 -66.68 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -178.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -73.49 -43.79 59.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.253 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 15.0 t70 -52.64 -48.4 66.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.998 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 36.7 m -71.3 -42.76 68.25 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.338 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 55.0 mt -56.8 -45.94 81.91 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.147 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 18.2 m -62.19 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.906 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 79.4 m -59.8 -49.86 76.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.865 0.364 . . . . 0.0 110.918 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.541 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.6 t80 -60.86 -55.31 34.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.826 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.505 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 76.0 mt -54.35 -50.41 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.669 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -58.34 -43.34 88.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.782 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 -43.82 92.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.488 -179.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 200' ' ' PHE . 17.8 t -73.5 -22.29 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-O 121.34 0.591 . . . . 0.0 110.562 -178.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 9.9 mmm180 . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.138 172.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.233 0.187 0 CA-C-O 120.989 0.423 . . . . 0.0 111.64 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.582 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.4 mp0 -57.17 -36.01 70.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.73 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 31.8 t -61.17 -43.04 99.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.224 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.412 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.4 tt -62.75 -46.01 90.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.728 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.573 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.5 t80 -52.88 -59.53 4.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.543 177.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.458 ' HE2' HD11 ' A' ' 201' ' ' ILE . 51.3 m-85 -65.18 -36.21 83.49 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -174.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.47 -45.18 94.21 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . 0.434 ' HD2' HD13 ' B' ' 515' ' ' LEU . 23.6 ttmm -67.8 -40.85 83.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.637 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.573 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.2 t -56.21 -48.6 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.903 0.383 . . . . 0.0 110.462 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . 0.408 ' O ' ' HD3' ' B' ' 472' ' ' ARG . 1.5 tmt_? -57.07 -45.21 83.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.381 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -76.94 -37.04 56.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.666 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -69.61 -41.08 76.19 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -176.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.13 -32.56 73.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.422 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 40.2 ttt180 69.28 -1.63 2.11 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.875 0.735 . . . . 0.0 111.875 173.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 21.4 t -127.14 131.31 50.79 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.23 -35.66 80.04 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.106 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.01 -37.87 81.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.342 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.24 -37.5 78.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.859 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -68.87 -37.69 79.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.003 0.43 . . . . 0.0 109.907 177.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.9 tt0 -61.37 -42.44 98.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.474 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 1.7 t-20 -52.21 -51.41 58.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.036 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 87.8 t80 -52.71 -47.62 67.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.682 177.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.03 -33.31 75.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.203 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.908 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.8 mtt180 -66.37 -37.74 85.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 176.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 84.1 m -61.18 -36.3 79.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.864 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.541 HD22 ' CG ' ' A' ' 200' ' ' PHE . 62.0 mt -68.89 -45.84 69.93 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.566 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -64.62 -42.31 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.478 -178.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.437 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 17.6 pt -69.18 -32.02 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.608 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.85 -44.3 90.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.079 0.466 . . . . 0.0 109.987 172.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -68.85 -16.68 63.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.831 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -101.37 16.49 25.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.27 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 65.56 10.84 6.99 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.425 0.453 . . . . 0.0 111.647 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.9 t -70.55 -47.22 66.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.915 0.388 . . . . 0.0 110.807 -176.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.6 pt -112.07 179.71 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.182 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.0 m -119.8 170.95 8.77 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.057 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.5 ' O ' HG23 ' B' ' 502' ' ' VAL . 55.6 ttp180 -50.57 -56.52 11.37 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.519 0.512 . . . . 0.0 111.384 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.34 -43.65 83.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.336 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 12.4 mm-40 -56.01 -49.0 74.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.362 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.459 ' C ' HD23 ' B' ' 501' ' ' LEU . 8.9 tt -61.64 -46.27 90.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.765 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 498' ' ' ARG . 90.2 t -59.76 -36.69 67.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -82.32 -27.12 32.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.468 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 20.7 mt -65.0 -43.19 93.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.004 0.43 . . . . 0.0 111.528 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.47 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.4 p -84.63 11.51 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.108 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.456 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 32.9 t -59.73 -50.07 88.61 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.158 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.467 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 11.5 Cg_endo -60.56 -8.2 8.56 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.255 1.97 . . . . 0.0 113.308 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.467 ' CE2' ' HG2' ' B' ' 507' ' ' PRO . 65.9 m-85 -110.45 -61.38 1.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.249 -175.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.572 HD22 HD23 ' B' ' 515' ' ' LEU . 74.7 mt -96.93 -14.79 21.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.807 -0.179 . . . . 0.0 111.474 -174.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.8 -19.04 64.9 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.668 -176.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -85.73 -3.81 59.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.694 0.283 . . . . 0.0 110.812 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.456 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 74.0 m-85 -122.98 95.11 46.57 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.69 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 8.2 Cg_endo -51.24 -50.75 12.92 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.21 2.606 . . . . 0.0 113.1 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.73 -39.17 87.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.9 0.381 . . . . 0.0 111.577 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.572 HD23 HD22 ' B' ' 509' ' ' LEU . 14.6 tp -78.13 -41.38 35.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 -173.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -66.96 -39.25 87.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.681 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.84 -36.19 83.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.582 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 8.7 t90 -59.4 -49.03 79.37 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.44 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.3 OUTLIER -62.48 -42.66 99.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.627 -177.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -61.96 -40.15 94.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.793 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -63.42 -47.61 81.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.049 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.91 -35.18 79.92 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.01 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.52 -9.23 58.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.657 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.08 41.18 61.04 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.203 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.8 t80 . . . . . 0 C--N 1.322 -0.593 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.887 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 37.7 m . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.507 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 2.6 Cg_exo -75.61 163.37 34.1 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.543 2.162 . . . . 0.0 111.829 176.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -114.78 154.23 28.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.472 -178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.807 HG11 HD21 ' B' ' 483' ' ' ASN . 3.7 p -112.17 135.61 50.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.365 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -101.15 133.65 45.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.155 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.429 ' HB2' HG13 ' A' ' 179' ' ' VAL . 64.7 mt -114.82 3.31 14.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.65 0.738 . . . . 0.0 110.117 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -28.76 40.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.43 -0.804 . . . . 0.0 108.956 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.431 ' HG3' ' N ' ' A' ' 153' ' ' LEU . 3.7 pt20 -59.13 -32.05 69.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.475 175.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.566 HD11 HD21 ' B' ' 504' ' ' LEU . 69.3 mt -69.23 166.83 17.57 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.399 0.619 . . . . 0.0 112.186 -172.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -73.57 163.95 27.32 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.406 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.43 -44.8 76.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.278 0.561 . . . . 0.0 109.842 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -64.83 -31.3 72.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.165 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.4 m -60.55 -45.73 92.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.17 0.51 . . . . 0.0 110.797 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 182' ' ' VAL . 87.4 mt -68.91 -38.56 79.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.791 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -63.05 -40.39 97.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.512 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -64.08 -41.58 97.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.272 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -54.02 -52.29 61.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.762 173.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.637 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 22.5 mtpp -67.19 -28.13 67.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.207 -175.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -78.22 -42.57 30.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.681 0.277 . . . . 0.0 111.148 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -77.43 -36.78 52.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.687 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.499 ' CE1' HG22 ' B' ' 490' ' ' ILE . 43.7 m-85 -83.72 -4.21 58.42 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.337 178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 59.03 78.77 0.25 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.625 0.578 . . . . 0.0 111.174 178.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.607 HD12 ' HG2' ' A' ' 162' ' ' LYS . 92.5 mt -115.71 113.19 42.58 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.06 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 15.9 Cg_exo -68.07 135.92 36.27 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.647 2.898 . . . . 0.0 112.057 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.422 ' CG2' HD11 ' A' ' 173' ' ' LEU . 3.7 t . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.652 -177.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.422 HD11 ' CG2' ' A' ' 169' ' ' THR . 86.5 mt . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 120.854 0.359 . . . . 0.0 110.56 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.443 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 88.4 m-20 -113.59 178.03 4.42 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.256 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.696 ' O ' HG23 ' A' ' 179' ' ' VAL . 55.4 tptt -46.05 -57.91 4.05 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.879 0.737 . . . . 0.0 112.166 -177.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -54.52 -49.63 69.76 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -176.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.1 -43.02 91.84 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.017 0.437 . . . . 0.0 110.594 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 94.8 mt -61.81 -48.85 78.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.022 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 175' ' ' LYS . 13.6 t -58.66 -42.6 85.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.501 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 19.3 mm-40 -58.28 -49.74 76.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.651 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.637 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 79.6 mt -65.4 -48.48 82.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.068 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.1 t -59.28 -45.76 92.88 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.959 -177.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.16 -39.91 94.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.374 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.4 t -59.22 -40.49 86.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.755 0.312 . . . . 0.0 110.726 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -87.25 -26.43 23.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.776 0.322 . . . . 0.0 111.089 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.58 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 27.4 t80 -60.9 -44.02 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.008 0.523 . . . . 0.0 111.136 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -79.94 21.64 0.55 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.06 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 45.5 m -145.77 28.75 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.816 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.642 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 73.2 mt -90.1 125.38 60.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.666 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.47 140.3 51.97 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.837 2.358 . . . . 0.0 110.973 172.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.614 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.0 p -153.05 134.74 5.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.16 0.505 . . . . 0.0 110.925 -174.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -102.78 109.17 20.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.599 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 40.1 tt0 -47.89 -62.56 1.4 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -169.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -65.37 -45.13 85.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.504 0.192 . . . . 0.0 111.494 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.68 -43.26 99.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.601 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 89.7 m -65.2 -37.16 86.44 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.039 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 22.1 mt -60.99 -47.27 87.23 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.4 m -59.17 -46.06 89.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.354 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 69.3 m -61.15 -51.22 69.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.346 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.599 ' CD1' HD22 ' B' ' 488' ' ' LEU . 45.8 t80 -56.24 -55.99 26.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.291 -178.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.599 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 74.9 mt -55.72 -48.86 77.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.21 -42.07 98.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.845 -177.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.4 m -62.95 -42.77 99.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.414 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 200' ' ' PHE . 56.6 t -68.84 -28.09 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.04 0.448 . . . . 0.0 110.736 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.599 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 14.2 mmm-85 . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.538 175.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . 0.428 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.0 OUTLIER . . . . . 0 N--CA 1.455 -0.201 0 CA-C-O 120.807 0.337 . . . . 0.0 111.707 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.48 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.1 mp0 -63.33 -40.84 98.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.127 177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.1 m -68.06 -29.84 68.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.229 176.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' B' ' 463' ' ' THR . 54.4 tp -64.91 -46.22 82.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.745 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.503 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.8 t80 -52.59 -58.88 5.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.61 175.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.549 ' HE2' HD11 ' A' ' 201' ' ' ILE . 59.3 m-85 -62.62 -32.07 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.76 -45.27 90.58 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.032 0.444 . . . . 0.0 110.393 176.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -63.39 -43.44 97.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.421 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.0 t -57.63 -43.72 84.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.068 0.461 . . . . 0.0 110.444 177.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -56.74 -50.9 70.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.552 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -77.29 -24.59 50.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.607 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -78.45 -42.1 30.89 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.71 -44.94 22.36 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.998 -177.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 70.06 -55.49 0.6 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.912 0.757 . . . . 0.0 111.927 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 8.8 t -63.74 125.97 26.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.438 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.62 -46.16 84.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.312 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -31.27 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.36 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.86 -41.87 64.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.988 0.423 . . . . 0.0 110.942 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.54 -37.54 77.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.246 0.546 . . . . 0.0 109.748 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 28.8 tt0 -64.29 -38.57 91.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.405 175.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.807 HD21 HG11 ' A' ' 148' ' ' VAL . 25.4 t-20 -58.03 -44.57 87.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.873 176.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -55.98 -45.79 78.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.166 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.614 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.7 mt -67.79 -29.13 68.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.227 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.686 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -62.99 -43.19 99.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.918 0.389 . . . . 0.0 110.101 173.62 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.63 -35.82 78.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.266 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.599 HD22 ' CD1' ' A' ' 200' ' ' PHE . 25.0 mt -66.52 -52.08 49.72 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.265 179.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 11.2 m -61.06 -41.91 91.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.563 HD13 ' HE1' ' A' ' 186' ' ' PHE . 18.7 pt -69.7 -27.49 33.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.838 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -67.89 -39.1 83.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 109.841 172.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . 0.554 HD21 ' HA ' ' A' ' 200' ' ' PHE . 14.8 m120 -72.48 -35.28 68.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.261 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.06 18.65 3.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.528 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 56.26 49.11 15.89 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.162 0.506 . . . . 0.0 111.463 178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 75.7 t -103.43 -49.26 10.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.582 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 44.8 pt -112.24 172.16 3.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.917 0.389 . . . . 0.0 110.966 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.409 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 18.9 p -109.43 179.73 4.06 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.786 176.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.521 ' O ' HG23 ' B' ' 502' ' ' VAL . 57.9 ttp180 -59.85 -47.83 84.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.775 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.76 70.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.784 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.474 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 5.4 mm-40 -56.36 -46.03 80.2 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.158 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.408 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 63.6 tp -58.31 -48.62 79.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.43 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.546 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 67.1 t -65.65 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.16 -177.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.402 HE21 ' HB2' ' B' ' 503' ' ' GLN . 16.2 mt-30 -77.04 -30.69 55.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -176.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.566 HD21 HD11 ' A' ' 153' ' ' LEU . 44.3 mt -66.73 -41.62 87.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.984 0.421 . . . . 0.0 111.78 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -86.94 10.41 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.353 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.672 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 78.2 p -64.77 -44.2 72.18 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.672 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 24.1 Cg_exo -67.46 -8.53 22.45 Favored 'Trans proline' 0 C--N 1.358 1.068 0 C-N-CA 122.086 1.858 . . . . 0.0 111.977 176.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -99.92 -67.9 0.83 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.753 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.612 HD22 HD23 ' B' ' 515' ' ' LEU . 67.0 mt -96.22 -8.1 33.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.438 -173.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.68 -16.31 61.01 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 121.093 -0.575 . . . . 0.0 113.043 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.592 ' HE3' ' O ' ' B' ' 507' ' ' PRO . 0.0 OUTLIER -87.76 -2.91 58.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.932 0.396 . . . . 0.0 110.518 178.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -117.77 96.78 50.02 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.732 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.52 -52.5 8.75 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.195 2.596 . . . . 0.0 112.879 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.21 -39.82 87.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.905 0.383 . . . . 0.0 111.461 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.612 HD23 HD22 ' B' ' 509' ' ' LEU . 25.4 tp -79.8 -44.1 21.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.957 -172.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.404 ' CD2' ' HE3' ' B' ' 520' ' ' LYS . 8.7 t80 -69.02 -32.98 72.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.284 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -73.77 -35.37 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.125 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.48 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 11.5 t90 -56.38 -48.82 76.08 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 173.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.546 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 21.6 t80 -55.92 -45.93 78.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.678 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' B' ' 516' ' ' PHE . 99.0 mttt -59.71 -47.93 83.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.107 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -62.21 -41.92 98.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -177.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -64.75 -35.54 81.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.052 0.453 . . . . 0.0 110.694 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.48 -7.15 57.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.172 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 68.41 26.82 74.09 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.969 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 85.4 t80 . . . . . 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 110.531 -176.278 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 97.9 m . . . . . 0 C--O 1.233 0.186 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.17 143.03 82.76 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.241 1.96 . . . . 0.0 111.748 176.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -98.66 118.99 36.62 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.148 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.0 p -81.97 123.66 38.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.304 0.574 . . . . 0.0 110.792 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -89.39 131.26 35.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.177 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.465 ' HB2' HG13 ' A' ' 179' ' ' VAL . 96.8 mt -111.21 6.38 20.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.242 0.544 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -81.66 -26.73 34.51 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.559 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 28.0 pt20 -67.79 -22.51 65.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.578 175.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.628 HD21 HD21 ' B' ' 504' ' ' LEU . 30.8 mt -67.26 151.14 48.04 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . 0.488 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 50.9 mt-30 -63.83 148.46 49.26 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.528 HG12 ' HE ' ' A' ' 159' ' ' ARG . 48.3 t -56.96 -46.85 84.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.199 0.523 . . . . 0.0 109.892 178.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.17 -33.42 74.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.606 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.783 HG21 ' HG2' ' B' ' 500' ' ' GLU . 25.8 m -64.42 -45.67 86.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.897 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.6 mt -64.25 -37.32 87.05 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 110.519 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.528 ' HE ' HG12 ' A' ' 155' ' ' VAL . 74.2 mtt-85 -67.68 -38.13 83.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.53 176.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.6 ttm180 -65.2 -42.88 93.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.061 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.432 ' OH ' HD11 ' A' ' 189' ' ' ILE . 58.0 t80 -53.3 -47.81 68.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.916 173.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.644 ' NZ ' ' HB ' ' A' ' 181' ' ' ILE . 43.6 mttp -61.33 -49.43 77.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.823 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -63.79 -48.1 78.24 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -65.66 -41.77 92.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.91 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -87.0 3.22 46.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.666 -178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 55.74 60.58 3.22 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.043 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 162' ' ' LYS . 85.9 mt -94.45 130.7 32.91 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.957 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.33 125.24 15.85 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.163 1.909 . . . . 0.0 111.423 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.402 HG21 ' HD3' ' A' ' 162' ' ' LYS . 3.2 p . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.938 -177.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 90.9 mt . . . . . 0 C--O 1.233 0.21 0 CA-C-O 121.042 0.449 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.501 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 6.2 m-20 -104.21 164.74 11.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.529 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' A' ' 155' ' ' VAL . 5.8 tmtt? -56.33 -50.08 72.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.667 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.95 85.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.427 ' HA ' ' HG2' ' A' ' 180' ' ' GLU . 10.2 mm-40 -61.63 -41.71 97.87 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.555 0.693 . . . . 0.0 110.249 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 98.7 mt -61.85 -52.06 65.69 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.883 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.465 HG13 ' HB2' ' A' ' 150' ' ' LEU . 78.5 t -58.24 -48.99 83.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 O-C-N 123.614 0.571 . . . . 0.0 111.626 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.549 ' HG3' ' N ' ' A' ' 181' ' ' ILE . 6.7 pt-20 -62.02 -46.19 90.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.44 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.644 ' HB ' ' NZ ' ' A' ' 162' ' ' LYS . 80.6 mt -70.95 -39.27 74.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 120.622 0.249 . . . . 0.0 110.916 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 54.6 t -64.66 -47.55 88.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.94 -41.16 98.77 Favored Glycine 0 N--CA 1.449 -0.482 0 O-C-N 123.454 0.471 . . . . 0.0 112.432 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.7 t -59.19 -45.14 91.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.891 0.377 . . . . 0.0 110.544 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -78.27 -29.76 48.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.538 ' HE1' HD13 ' B' ' 490' ' ' ILE . 15.3 t80 -60.83 -39.02 87.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.683 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -75.78 6.6 4.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 p -128.88 21.09 5.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.922 0.392 . . . . 0.0 111.248 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.726 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.3 mt -88.85 118.35 69.2 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.417 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 5.3 Cg_exo -78.22 137.74 15.44 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.003 2.469 . . . . 0.0 111.569 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.506 HG11 ' HB3' ' B' ' 485' ' ' LEU . 0.0 OUTLIER -124.77 167.18 19.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.21 0.528 . . . . 0.0 111.786 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -125.28 110.38 13.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.684 174.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -48.36 -59.82 3.16 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.392 0.433 . . . . 0.0 111.766 -172.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -55.55 -57.37 12.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.68 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.43 -48.37 79.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.602 -173.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.1 m -63.59 -41.14 98.38 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.541 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 68.8 mt -65.17 -43.22 92.42 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.193 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.1 m -59.26 -41.09 87.98 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.699 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 91.7 m -58.36 -55.99 27.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 176.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.524 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 60.6 t80 -57.53 -50.81 71.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.399 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.482 HD11 ' HE2' ' B' ' 468' ' ' PHE . 63.9 mt -57.36 -55.13 22.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.766 -175.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.48 -32.74 70.39 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.0 m -70.45 -45.97 64.73 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.218 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.1 -27.96 20.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.974 0.416 . . . . 0.0 111.158 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.188 177.543 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.246 0 CA-C-O 120.823 0.344 . . . . 0.0 111.497 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.466 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.6 mp0 -58.56 -43.77 89.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.598 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 6.8 m -59.29 -44.07 92.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.028 0.442 . . . . 0.0 110.441 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.08 -49.83 76.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.815 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.4 t80 -53.03 -55.87 20.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.6 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.524 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 29.9 m-85 -63.92 -34.25 77.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.42 -43.65 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.542 -0.463 . . . . 0.0 109.985 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.56 -45.28 93.64 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 175.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.513 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -57.31 -49.41 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.987 0.422 . . . . 0.0 110.383 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -62.68 -38.41 90.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.838 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 tptp -80.35 -33.01 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.521 -174.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -80.56 -46.25 16.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.319 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.1 -46.66 87.73 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.7 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 51.1 mtt85 71.55 -49.24 0.68 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.74 0.65 . . . . 0.0 112.705 173.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.0 t -66.21 129.45 39.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.711 -178.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.34 70.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.727 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -75.55 -22.5 56.99 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.835 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -66.28 -51.41 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.133 0.492 . . . . 0.0 110.117 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' B' ' 485' ' ' LEU . 90.5 t80 -63.37 -40.64 97.8 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.945 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.572 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 38.1 tt0 -60.76 -42.78 98.11 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.865 177.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.418 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 6.9 t30 -59.38 -39.9 84.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.6 -45.95 81.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.389 0.614 . . . . 0.0 109.915 172.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.506 ' HB3' HG11 ' A' ' 191' ' ' VAL . 83.5 mt -67.02 -33.19 75.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.362 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.0 OUTLIER -57.75 -45.79 85.41 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.224 0.535 . . . . 0.0 109.867 174.132 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 36.4 m -59.69 -38.93 82.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.401 176.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.9 mt -65.34 -49.31 69.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 10.8 m -63.76 -42.89 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.665 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.538 HD13 ' HE1' ' A' ' 186' ' ' PHE . 26.5 pt -69.89 -28.53 37.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.874 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -67.61 -43.05 81.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.172 0.511 . . . . 0.0 110.344 174.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -79.49 -16.21 56.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.791 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -98.64 21.26 11.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.361 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 65.84 25.74 11.23 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.404 0.44 . . . . 0.0 112.103 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.569 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 89.2 t -92.25 -56.19 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.755 0.312 . . . . 0.0 110.663 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 32.8 pt -111.04 162.48 8.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.726 0.298 . . . . 0.0 110.289 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 8.9 t -105.82 -175.24 2.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.13 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.543 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.3 ttm180 -55.85 -51.65 66.77 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.677 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -50.46 -50.81 51.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.892 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.783 ' HG2' HG21 ' A' ' 157' ' ' THR . 3.8 mp0 -60.47 -45.17 94.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.939 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.615 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 64.9 tp -57.32 -46.0 83.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.029 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.784 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 54.5 t -64.54 -38.01 81.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.954 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.559 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 48.6 mt-30 -71.37 -42.48 68.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.912 -177.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.628 HD21 HD21 ' A' ' 153' ' ' LEU . 76.5 mt -63.33 -40.86 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.603 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.7 p -86.63 4.49 3.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.982 0.42 . . . . 0.0 111.262 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 24.0 t -59.0 -52.44 74.77 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.751 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' B' ' 506' ' ' SER . 10.8 Cg_endo -57.75 -18.35 33.5 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 122.082 1.854 . . . . 0.0 113.154 176.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.71 -52.0 5.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.603 ' HG ' HG22 ' B' ' 505' ' ' VAL . 62.4 mt -97.71 -11.72 23.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.536 -174.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.56 -14.04 64.14 Favored Glycine 0 C--O 1.23 -0.136 0 C-N-CA 121.391 -0.433 . . . . 0.0 112.875 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 53.1 mttm -77.22 -15.51 59.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.271 0.557 . . . . 0.0 109.659 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -124.08 96.89 41.55 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.247 -176.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -49.58 -48.3 19.56 Favored 'Trans proline' 0 CA--C 1.529 0.253 0 C-N-CA 123.234 2.622 . . . . 0.0 113.504 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -66.94 -40.6 87.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.985 0.421 . . . . 0.0 111.088 -177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 18.5 tp -69.23 -44.84 71.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.523 -175.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -68.31 -32.88 73.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.087 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -63.5 -43.0 98.48 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.466 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 12.4 t90 -57.28 -49.06 77.26 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.846 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.784 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 66.9 t80 -59.04 -46.72 87.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.145 -178.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -64.17 -36.25 83.46 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.968 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -72.01 -37.42 69.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.108 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -66.87 -34.35 77.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.28 0.562 . . . . 0.0 110.583 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.484 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 9.0 mp -83.93 -14.65 50.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.038 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.97 35.82 61.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.139 -174.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 79.1 t80 . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.253 -0.473 . . . . 0.0 110.468 -177.657 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.9 m . . . . . 0 C--O 1.236 0.365 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -57.91 133.26 54.74 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.367 2.044 . . . . 0.0 111.296 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.42 110.09 6.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.302 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -73.7 110.36 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.589 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 18.9 t0 -72.38 88.15 1.18 Allowed 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.555 HD23 HD22 ' B' ' 504' ' ' LEU . 95.7 mt -89.57 -8.06 53.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.818 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -82.69 -23.06 34.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.865 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.589 ' NE2' ' HB3' ' A' ' 149' ' ' ASP . 27.5 pt20 -74.2 -18.94 60.69 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.86 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.3 mt -65.79 155.27 36.71 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.742 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -71.26 158.93 35.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.159 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.411 HG13 ' CD1' ' A' ' 178' ' ' LEU . 16.6 t -60.67 -46.32 96.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 109.972 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 159' ' ' ARG . 84.7 m-20 -67.71 -21.34 65.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.733 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.3 m -69.5 -51.32 36.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.183 0.516 . . . . 0.0 110.468 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 30.7 mt -65.96 -32.58 74.16 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 122.034 0.921 . . . . 0.0 109.57 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.545 ' HB3' ' HA ' ' A' ' 156' ' ' ASN . 77.8 ttt180 -63.08 -43.37 98.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.581 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 17.8 ttm180 -69.5 -37.73 77.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.543 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.463 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 70.9 t80 -51.53 -57.37 9.25 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.605 0.24 . . . . 0.0 110.7 174.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 7.1 ptpp? -66.96 -27.02 67.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.794 0.33 . . . . 0.0 111.13 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -69.43 -47.95 62.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.777 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -71.93 -45.44 61.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.042 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.431 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 70.8 m-85 -81.74 1.91 32.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.331 -177.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 57.4 74.47 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.25 176.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.68 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 90.0 mt -111.45 106.86 57.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.944 177.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.473 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -58.63 126.02 20.04 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.305 2.003 . . . . 0.0 111.39 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.65 ' HB ' HD11 ' A' ' 173' ' ' LEU . 3.1 p . . . . . 0 C--N 1.32 -0.698 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.125 -176.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.65 HD11 ' HB ' ' A' ' 169' ' ' THR . 95.8 mt . . . . . 0 CA--C 1.521 -0.136 0 CA-C-O 121.019 0.438 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.654 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 18.0 m120 -102.04 169.59 8.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.999 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.5 tptm -59.87 -54.24 48.5 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.317 -178.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.79 -33.39 72.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.982 0.42 . . . . 0.0 110.66 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.654 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 15.6 mm100 -62.0 -45.06 95.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.304 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 62.7 mt -59.14 -47.49 85.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.518 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 175' ' ' LYS . 18.3 t -59.29 -45.05 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.072 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -61.64 -46.13 91.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.17 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 86.8 mt -58.49 -45.84 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-O 121.165 0.507 . . . . 0.0 110.426 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.569 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 70.3 t -62.22 -48.63 87.52 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.991 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -65.02 -38.89 95.97 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.384 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 48.2 t -59.03 -43.29 91.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.801 0.334 . . . . 0.0 110.811 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -84.47 -23.23 29.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 110.951 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.569 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 20.7 t80 -64.41 -41.62 96.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.799 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -70.62 -18.35 62.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.677 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 14.9 p -106.5 27.41 8.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.636 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.9 mt -89.9 114.07 59.4 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.547 0.213 . . . . 0.0 110.448 175.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -68.49 103.92 1.03 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.436 2.091 . . . . 0.0 111.663 177.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.63 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.9 p -110.47 156.85 11.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -127.81 126.23 41.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.4 tt0 -50.9 -59.71 3.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.92 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.91 -57.16 13.83 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.62 -39.59 84.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 -171.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 95.6 m -67.58 -38.63 84.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.611 -178.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 39.6 mt -63.41 -46.11 87.9 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 174.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.6 m -59.09 -40.55 85.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.535 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 21.1 m -57.56 -55.79 30.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.248 177.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.552 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.5 t80 -62.09 -51.58 67.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.235 -175.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.55 -48.88 85.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.78 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -71.43 -31.2 66.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.081 -174.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.5 m -72.7 -53.97 10.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.198 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.518 HG11 HD23 ' B' ' 523' ' ' LEU . 54.4 t -65.29 -36.09 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.658 -174.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 . . . . . 0 C--N 1.328 -0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 111.079 177.18 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.6 t . . . . . 0 N--CA 1.451 -0.39 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -64.16 -47.91 78.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.663 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.2 m -60.77 -35.11 75.61 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.241 177.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 35.9 tp -63.08 -52.33 63.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.153 176.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.8 t80 -52.54 -57.89 8.53 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.95 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.401 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.8 m-85 -64.39 -34.53 78.38 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.4 -40.63 96.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.252 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.1 mttt -68.27 -34.92 77.06 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.696 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -63.1 -42.92 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.073 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.24 92.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.441 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -74.35 -36.55 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.185 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.574 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -66.6 -48.95 67.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.69 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . 0.435 HD23 ' O ' ' B' ' 480' ' ' ALA . 10.3 mp -71.43 -37.15 71.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.026 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 71.89 -60.83 0.51 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 124.134 0.896 . . . . 0.0 112.642 170.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 45.4 m -67.51 139.45 56.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.945 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -58.03 -44.72 87.51 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.06 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -65.12 -39.11 92.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.557 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.435 ' O ' HD23 ' B' ' 475' ' ' LEU . . . -62.09 -51.57 67.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.871 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -65.84 -36.94 84.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.215 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.684 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 30.3 tt0 -59.44 -42.13 91.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 175.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.65 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.1 t30 -60.8 -43.29 98.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.98 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.8 -45.19 70.7 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.325 0.583 . . . . 0.0 110.359 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 191' ' ' VAL . 86.2 mt -67.53 -31.81 72.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.466 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.684 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -63.39 -36.91 85.28 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.218 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.1 m -65.14 -36.2 83.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.897 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.552 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.3 mt -65.25 -48.55 72.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.337 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 13.9 m -65.04 -42.26 94.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.828 -177.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 186' ' ' PHE . 38.7 pt -69.15 -30.74 47.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.169 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -68.37 -45.01 73.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.111 0.481 . . . . 0.0 110.242 173.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -62.24 -38.8 90.61 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.991 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -86.31 16.28 4.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.698 -176.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . 0.427 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 0.1 OUTLIER 63.08 38.95 10.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.985 0.421 . . . . 0.0 111.045 174.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.581 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.9 t -96.7 -33.71 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.255 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 39.0 pt -124.73 153.32 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.929 0.395 . . . . 0.0 111.212 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 46.2 m -80.02 166.23 21.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.019 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.524 ' O ' HG23 ' B' ' 502' ' ' VAL . 20.7 ttm180 -54.92 -53.98 48.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.765 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.56 85.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.823 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.0 mm-40 -55.48 -46.29 76.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.67 -51.12 71.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.038 0.447 . . . . 0.0 110.99 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 498' ' ' ARG . 59.9 t -60.09 -35.44 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.667 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -67.42 -42.25 83.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.91 178.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.555 HD22 HD23 ' A' ' 150' ' ' LEU . 93.8 mt -66.77 -39.91 88.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 111.508 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.431 HG11 ' CE2' ' B' ' 519' ' ' PHE . 4.6 p -85.14 2.43 4.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.035 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.704 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 14.2 t -58.49 -53.84 62.1 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.357 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 31.8 Cg_exo -61.83 -26.66 79.57 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.744 1.629 . . . . 0.0 112.143 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -73.93 -60.59 2.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.575 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.575 HD22 HD23 ' B' ' 515' ' ' LEU . 78.8 mt -102.28 -10.39 19.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -172.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.21 -21.76 64.43 Favored Glycine 0 C--O 1.229 -0.166 0 C-N-CA 121.229 -0.51 . . . . 0.0 113.312 -176.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -81.98 0.95 37.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.079 0.466 . . . . 0.0 110.79 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.574 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 50.2 m-85 -125.58 90.29 50.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 174.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 -45.7 27.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.484 2.79 . . . . 0.0 113.602 -174.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.29 -45.23 73.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.975 0.417 . . . . 0.0 110.659 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.575 HD23 HD22 ' B' ' 509' ' ' LEU . 15.5 tp -67.89 -43.13 80.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.635 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 25.8 t80 -67.29 -38.84 85.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.446 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.69 -37.78 85.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.491 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.61 -49.3 75.35 Favored 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.431 ' CE2' HG11 ' B' ' 505' ' ' VAL . 66.0 t80 -58.86 -45.9 89.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.859 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.429 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 58.3 mtpt -62.95 -42.71 99.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.874 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . 0.409 HD22 ' C ' ' B' ' 521' ' ' ASN . 0.2 OUTLIER -66.44 -35.5 80.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.988 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.21 -42.72 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.346 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.518 HD23 HG11 ' A' ' 204' ' ' VAL . 81.8 mt -78.21 -14.96 59.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.374 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 78.15 15.98 80.33 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.345 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 61.2 t80 . . . . . 0 C--N 1.325 -0.485 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.61 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.3 m . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -73.72 155.63 49.17 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.534 2.156 . . . . 0.0 111.159 177.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -123.02 145.93 48.09 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.772 0.32 . . . . 0.0 111.256 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.87 125.23 51.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.91 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.438 ' HB2' ' OE1' ' A' ' 152' ' ' GLN . 11.0 m-20 -72.96 -30.49 63.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.687 -174.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.439 HD23 HD22 ' B' ' 504' ' ' LEU . 64.8 mt 60.5 7.16 1.26 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.114 -176.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -75.14 -26.42 59.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.457 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.6 OUTLIER -61.59 -17.87 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.076 -177.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.591 ' O ' ' HB ' ' A' ' 157' ' ' THR . 28.1 mt -80.42 4.6 17.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . 0.673 ' HA ' HE21 ' A' ' 154' ' ' GLN . 0.0 OUTLIER 55.61 -170.79 0.07 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.782 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.609 HG12 HD12 ' A' ' 178' ' ' LEU . 1.6 m -77.85 -37.64 23.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 121.632 -0.667 . . . . 0.0 110.776 172.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -58.21 -53.69 55.43 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' A' ' 153' ' ' LEU . 41.9 m -70.57 -34.68 72.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.641 0.258 . . . . 0.0 111.388 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 82.8 mt -63.06 -40.18 96.92 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.351 0.596 . . . . 0.0 110.523 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.2 mtt180 -69.88 -31.4 69.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.815 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 29.4 ttm180 -68.27 -42.37 79.65 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -52.05 -51.25 58.72 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.451 ' NZ ' HG23 ' A' ' 182' ' ' VAL . 54.4 mttp -61.01 -43.65 98.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.745 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -70.38 -38.87 74.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.29 -175.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -79.53 -35.52 39.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -176.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 59.3 m-85 -92.75 1.69 57.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 59.34 79.89 0.21 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.804 0.69 . . . . 0.0 111.38 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.439 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 96.8 mt -120.17 100.37 47.93 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.92 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -61.59 125.65 17.23 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.382 2.055 . . . . 0.0 111.657 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--N 1.323 -0.57 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.883 -175.694 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.073 0.463 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.599 ' HB3' ' HG2' ' A' ' 177' ' ' GLN . 56.5 t30 -142.0 165.5 27.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.257 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 154' ' ' GLN . 27.2 tptp -50.22 -54.85 18.14 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 122.84 0.456 . . . . 0.0 111.546 -178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.49 93.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.332 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.599 ' HG2' ' HB3' ' A' ' 174' ' ' ASN . 8.6 mm100 -64.42 -38.56 91.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.54 0.686 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.609 HD12 HG12 ' A' ' 155' ' ' VAL . 96.6 mt -61.9 -44.86 95.93 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.929 176.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.27 -50.34 80.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 O-C-N 123.58 0.55 . . . . 0.0 111.36 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -56.41 -53.71 54.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.619 0.247 . . . . 0.0 111.476 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 64.1 mt -62.63 -40.71 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-O 120.714 0.292 . . . . 0.0 111.036 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.451 HG23 ' NZ ' ' A' ' 162' ' ' LYS . 39.2 t -64.64 -47.82 87.32 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.22 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.32 -36.28 92.84 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.349 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.2 t -58.63 -47.4 84.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.317 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -80.13 -28.44 38.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -61.0 -47.68 85.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.137 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -74.53 -3.66 32.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -106.94 17.29 23.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.991 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.675 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.4 mt -87.98 117.74 68.82 Favored Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.881 178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 3.3 Cg_exo -74.64 100.07 1.29 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.863 2.375 . . . . 0.0 111.0 175.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.445 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 13.3 p -115.46 135.2 56.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.061 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -108.05 125.72 51.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.027 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.465 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.0 tt0 -50.97 -59.71 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 123.63 0.581 . . . . 0.0 112.39 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -51.8 -58.21 7.09 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.656 0.614 . . . . 0.0 112.656 -173.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.02 -41.5 97.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.084 -176.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 54.7 m -65.92 -42.85 89.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 201' ' ' ILE . 53.1 mt -59.46 -43.84 93.11 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 41.8 m -59.5 -48.41 81.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.771 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.96 -49.15 78.94 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.788 0.328 . . . . 0.0 110.626 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' B' ' 488' ' ' LEU . 46.2 t80 -59.35 -60.39 3.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.699 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.511 HD11 ' HE2' ' B' ' 468' ' ' PHE . 46.9 mt -58.11 -44.7 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.002 0.43 . . . . 0.0 110.497 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -61.87 -41.21 97.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.966 -178.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -63.56 -51.67 64.39 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.801 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.3 t -65.69 -28.8 45.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.226 -175.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 . . . . . 0 C--O 1.234 0.256 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.615 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.8 p . . . . . 0 N--CA 1.453 -0.29 0 CA-C-O 121.062 0.458 . . . . 0.0 110.975 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.16 -42.84 91.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.791 176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 5.8 t -64.15 -35.74 81.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.284 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.36 -44.44 96.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.099 177.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.543 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.3 t80 -53.24 -55.02 27.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.511 ' HE2' HD11 ' A' ' 201' ' ' ILE . 63.5 m-85 -65.49 -32.35 73.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.13 -40.51 97.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.531 . . . . 0.0 110.253 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -68.19 -44.12 76.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.537 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.543 HG23 ' O ' ' B' ' 467' ' ' PHE . 59.8 t -55.12 -43.64 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.188 0.518 . . . . 0.0 110.052 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 28.9 mtt-85 -57.09 -53.0 63.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.799 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -73.28 -33.63 65.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.729 -174.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.572 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -73.62 -47.93 36.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.773 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.8 mp -69.26 -34.45 74.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.791 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 71.65 -40.54 0.48 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.937 0.773 . . . . 0.0 112.298 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 22.8 t -83.97 127.98 34.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.829 0.347 . . . . 0.0 110.387 -175.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.93 -46.51 84.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.664 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.21 -24.91 61.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.07 -176.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.86 -42.02 81.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.129 0.49 . . . . 0.0 109.826 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -66.69 -35.58 80.48 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 41.6 tt0 -62.52 -43.07 99.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.231 175.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.3 -45.87 72.66 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.628 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.559 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 82.3 t80 -54.98 -49.05 72.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.3 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 193' ' ' GLU . 89.1 mt -63.94 -34.47 78.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.548 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.675 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.5 mtt180 -67.66 -36.8 81.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.101 0.477 . . . . 0.0 110.349 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.53 -34.03 76.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.707 174.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 200' ' ' PHE . 50.5 mt -68.04 -44.2 76.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.412 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.477 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.8 m -66.72 -42.87 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.401 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.433 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 19.3 pt -69.66 -26.79 31.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.752 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -67.88 -39.33 83.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.102 0.477 . . . . 0.0 110.149 173.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -71.69 -26.12 62.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.965 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -93.6 18.07 10.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 64.78 14.58 9.25 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.562 0.538 . . . . 0.0 111.762 176.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.548 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 62.0 t -76.37 -41.5 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.852 0.358 . . . . 0.0 110.355 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.44 HG22 ' CG2' ' A' ' 157' ' ' THR . 37.1 pt -122.39 169.63 13.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.975 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 9.0 t -121.01 -176.0 3.17 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.618 ' HG3' ' HB3' ' B' ' 523' ' ' LEU . 22.9 ttm180 -57.53 -48.13 80.13 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.164 0.29 . . . . 0.0 111.639 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -56.79 -54.55 45.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.742 -174.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 1.7 pm0 -69.69 -32.49 71.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.522 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 61.5 tp -58.32 -49.71 76.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.807 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 99.3 t -64.07 -39.81 86.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.676 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.457 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 98.4 mt-30 -71.3 -24.96 62.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.093 -178.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 79.7 mt -70.46 -40.46 73.7 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.154 -0.341 . . . . 0.0 111.233 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.528 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.5 p -91.16 5.33 5.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 110.552 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.558 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 9.5 t -58.41 -48.64 96.59 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.345 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.7 Cg_exo -61.93 -9.3 13.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 122.353 2.036 . . . . 0.0 112.998 176.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -107.25 -60.03 1.74 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.252 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.528 ' HG ' HG22 ' B' ' 505' ' ' VAL . 82.6 mt -90.25 -12.75 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.943 -175.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -68.03 -7.07 48.82 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.706 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 52.1 mttm -84.92 -17.35 38.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.236 0.541 . . . . 0.0 109.739 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.572 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 51.2 m-85 -122.48 97.93 44.23 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.136 -175.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.6 -52.18 9.46 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 123.437 2.758 . . . . 0.0 113.596 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -66.85 -30.78 71.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 111.3 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 29.6 tp -78.09 -43.78 28.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.189 0.519 . . . . 0.0 109.988 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 9.2 t80 -67.8 -31.86 72.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.719 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -66.86 -42.92 84.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.794 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -54.18 -49.79 68.51 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.807 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 73.5 t80 -58.78 -59.48 5.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.87 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -57.0 -40.21 76.17 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -176.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -62.84 -37.7 87.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.937 0.399 . . . . 0.0 110.653 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -67.83 -47.23 69.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.902 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.618 ' HB3' ' HG3' ' B' ' 498' ' ' ARG . 3.8 mm? -70.57 -17.4 62.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.887 -177.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.91 32.59 12.44 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.382 -175.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 21.3 t80 . . . . . 0 C--N 1.324 -0.542 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.835 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 98.9 m . . . . . 0 C--O 1.234 0.243 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 26.7 Cg_exo -62.32 136.49 60.0 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.444 2.096 . . . . 0.0 111.285 177.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -95.86 133.67 39.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.245 0.545 . . . . 0.0 111.856 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 p -92.75 102.97 14.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.457 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.61 117.93 13.79 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.54 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.45 1.9 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.13 0.49 . . . . 0.0 110.764 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -80.37 -26.99 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.729 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.621 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 6.1 pt20 -67.45 -20.91 65.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.153 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.554 HD11 HD21 ' B' ' 504' ' ' LEU . 73.0 mt -72.11 165.81 23.58 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.368 0.604 . . . . 0.0 112.182 -174.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . 0.55 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 23.0 mt-30 -72.2 154.15 41.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.552 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.1 t -63.12 -46.01 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.029 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -61.48 -33.15 73.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.631 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.55 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 48.2 m -61.93 -50.92 70.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.012 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.3 -39.4 93.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.126 0.489 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -67.96 -30.39 69.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.765 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.555 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.9 ttm180 -70.4 -40.86 73.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.57 ' HA ' HG13 ' B' ' 495' ' ' VAL . 61.6 t80 -57.03 -52.25 66.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.27 173.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.57 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.2 mtpm? -59.63 -33.62 71.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.992 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -78.19 -42.96 29.89 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.769 0.319 . . . . 0.0 111.232 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -67.07 -42.42 84.74 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -178.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -92.47 -1.38 57.02 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm 58.2 79.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.504 0.503 . . . . 0.0 111.597 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.735 HD23 HG22 ' A' ' 181' ' ' ILE . 11.0 mp -103.27 120.02 53.33 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.76 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 12.9 Cg_exo -68.97 129.71 18.94 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 123.572 2.848 . . . . 0.0 112.464 -175.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.448 HG21 HD11 ' A' ' 173' ' ' LEU . 8.9 t . . . . . 0 C--N 1.326 -0.437 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.925 -179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.448 HD11 HG21 ' A' ' 169' ' ' THR . 81.9 mt . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.622 0.248 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.453 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 31.5 m-80 -85.43 177.9 7.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.612 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.635 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.9 tptm -57.8 -52.59 64.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.388 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.8 -40.26 79.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 111.159 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -59.56 -48.02 83.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.332 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 91.2 mt -60.49 -48.71 80.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.138 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.2 t -58.8 -46.68 90.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.302 -175.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.29 -39.32 82.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 -177.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.735 HG22 HD23 ' A' ' 167' ' ' LEU . 70.7 mt -67.78 -47.34 80.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 120.805 0.336 . . . . 0.0 110.748 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.62 -47.29 85.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.78 -36.07 92.2 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.563 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 25.0 t -62.58 -39.54 94.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.853 0.359 . . . . 0.0 110.683 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -85.86 -31.75 22.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.765 0.317 . . . . 0.0 110.995 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -63.54 -40.54 97.3 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.843 0.457 . . . . 0.0 112.131 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -74.41 -6.55 48.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 111.55 -177.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 62.8 m -111.89 23.38 13.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.883 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 76.0 mt -84.17 116.04 63.01 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.672 0.272 . . . . 0.0 110.953 177.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 6.2 Cg_exo -74.41 105.59 2.08 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.073 2.516 . . . . 0.0 110.751 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.8 p -108.65 143.43 18.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.895 0.378 . . . . 0.0 111.368 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -110.78 113.24 25.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.943 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 47.7 tt0 -46.01 -60.28 2.36 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -60.17 -53.68 54.8 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -63.96 -39.51 94.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.884 0.373 . . . . 0.0 110.834 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 75.4 m -64.74 -43.73 92.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 -178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 63.6 mt -60.82 -45.06 95.9 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -56.91 -47.0 81.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.675 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 83.2 m -61.09 -50.78 71.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.417 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.581 ' CD1' HD22 ' B' ' 488' ' ' LEU . 87.1 t80 -60.93 -49.71 76.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.081 -177.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.459 HD11 ' HE2' ' B' ' 468' ' ' PHE . 83.9 mt -57.71 -49.95 79.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.382 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -63.27 -33.11 74.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.419 -179.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 42.4 m -69.2 -53.21 21.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.709 0.29 . . . . 0.0 110.715 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 200' ' ' PHE . 15.2 t -66.72 -25.42 34.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.787 0.327 . . . . 0.0 110.987 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 . . . . . 0 C--N 1.328 -0.357 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.567 176.858 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . 0.471 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 2.8 p . . . . . 0 N--CA 1.455 -0.206 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.463 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -68.28 -42.82 78.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.221 177.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -64.39 -35.53 81.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.022 0.439 . . . . 0.0 110.071 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' B' ' 463' ' ' THR . 18.8 tp -55.13 -53.51 55.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.915 174.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.536 ' CE1' ' HG ' ' B' ' 515' ' ' LEU . 79.4 t80 -54.15 -52.24 61.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.049 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.459 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.1 m-85 -64.79 -34.99 79.66 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.95 -43.12 93.77 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.33 0.586 . . . . 0.0 109.9 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.97 -45.6 94.11 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.146 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 467' ' ' PHE . 94.0 t -58.89 -40.57 80.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.533 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -54.07 -48.28 70.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.262 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 476' ' ' ARG . 81.8 tttt -82.94 -35.02 26.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -178.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -66.71 -49.2 66.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . 0.413 HD13 HG13 ' B' ' 471' ' ' VAL . 8.6 mp -67.47 -34.05 76.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.481 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' B' ' 473' ' ' LYS . 38.4 mtm180 69.0 -58.1 0.5 Allowed 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.968 0.792 . . . . 0.0 112.377 176.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.0 t -67.54 129.96 41.55 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.849 0.357 . . . . 0.0 110.191 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.22 71.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.496 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.47 -36.62 74.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.111 0.482 . . . . 0.0 109.871 176.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.542 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.41 -45.73 78.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.4 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.416 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 70.5 t80 -65.29 -39.5 92.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.105 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 36.8 tt0 -59.25 -42.68 91.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.243 175.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.62 -43.05 99.57 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -56.4 -45.88 80.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 174.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.473 ' HB3' HG21 ' A' ' 191' ' ' VAL . 93.1 mt -66.12 -33.37 75.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.927 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.883 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 10.7 mtt85 -66.52 -36.7 83.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.052 0.453 . . . . 0.0 110.178 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.2 m -61.21 -37.24 82.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.119 0.485 . . . . 0.0 109.776 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 200' ' ' PHE . 38.6 mt -64.92 -46.99 79.36 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.473 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 17.1 m -64.18 -41.26 91.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.562 -178.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 30.0 pt -69.42 -34.92 64.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.209 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 501' ' ' LEU . 90.0 t80 -61.65 -47.08 87.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.157 0.503 . . . . 0.0 109.846 172.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -61.38 -35.11 76.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.547 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -87.59 13.98 9.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.512 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.87 24.12 14.37 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 111.121 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.57 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.4 t -76.43 -39.11 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.644 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.616 HD11 HD22 ' B' ' 501' ' ' LEU . 30.9 pt -132.26 158.94 43.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.205 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 3.6 p -94.69 -178.3 4.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.814 0.34 . . . . 0.0 111.792 -176.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.486 ' O ' HG23 ' B' ' 502' ' ' VAL . 41.4 ttp180 -55.67 -55.09 36.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.735 -175.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -58.67 -39.93 82.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.5 -176.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 6.3 mm-40 -61.61 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.805 0.336 . . . . 0.0 110.385 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 491' ' ' PHE . 0.2 OUTLIER -59.09 -50.58 73.52 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.542 0.687 . . . . 0.0 109.747 177.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 498' ' ' ARG . 58.0 t -60.64 -35.19 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.704 -1.135 . . . . 0.0 111.097 -177.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.621 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 75.9 mt-30 -79.15 -35.8 41.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.675 -178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.554 HD21 HD11 ' A' ' 153' ' ' LEU . 67.3 mt -68.19 -38.62 82.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.876 0.37 . . . . 0.0 111.44 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.559 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.6 p -86.26 1.43 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.126 0.489 . . . . 0.0 110.877 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.563 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.2 t -60.54 -47.74 95.38 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.813 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.572 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 32.4 Cg_exo -62.24 -7.08 9.37 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.285 1.99 . . . . 0.0 112.715 175.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -104.15 -58.25 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.833 0.349 . . . . 0.0 110.766 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.559 ' HG ' HG22 ' B' ' 505' ' ' VAL . 80.9 mt -88.49 -2.06 58.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.497 -174.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -65.83 -18.05 65.88 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.08 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 2.5 mptp? -92.21 -2.94 56.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.252 0.549 . . . . 0.0 109.645 178.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -127.55 85.25 61.28 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.853 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.16 -44.51 45.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.174 2.583 . . . . 0.0 112.927 -175.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.63 -46.27 89.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.024 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.536 ' HG ' ' CE1' ' B' ' 467' ' ' PHE . 2.2 tp -69.86 -40.73 75.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.736 -175.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.458 ' CE2' ' HD2' ' B' ' 520' ' ' LYS . 49.6 t80 -66.4 -41.76 88.86 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.2 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.23 -45.06 93.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.41 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.463 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 36.7 t90 -56.65 -48.6 77.21 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.145 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.604 ' CZ ' HD12 ' B' ' 501' ' ' LEU . 8.8 t80 -58.43 -47.29 84.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.856 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 50.6 mtpt -61.11 -42.49 98.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.758 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -65.56 -43.84 88.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.257 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.35 -45.51 83.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.89 0.376 . . . . 0.0 110.548 -178.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 89.4 mt -71.15 -26.91 63.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.608 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.78 36.6 8.42 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.668 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.0 t80 . . . . . 0 C--N 1.327 -0.381 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.819 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 39.3 m . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.434 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 10.7 Cg_exo -70.19 162.34 42.66 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.392 2.061 . . . . 0.0 111.045 176.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -114.67 146.58 40.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.028 0.442 . . . . 0.0 111.422 -175.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.65 124.48 62.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.71 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -88.6 135.37 33.53 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.214 175.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.51 HD13 HG12 ' A' ' 182' ' ' VAL . 94.5 mt -114.71 0.63 13.93 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.54 ' HA ' HG21 ' A' ' 179' ' ' VAL . 31.1 t80 -75.78 -25.41 56.41 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -66.67 -24.71 66.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.742 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.596 HD21 HD21 ' B' ' 504' ' ' LEU . 26.0 mt -62.48 147.95 47.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.852 0.358 . . . . 0.0 110.668 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 158' ' ' LEU . 17.9 mp0 -62.52 145.33 54.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.56 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 178' ' ' LEU . 5.6 p -57.32 -35.58 49.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.588 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -73.26 -33.82 65.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.898 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 34.6 m -65.02 -40.0 94.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.161 0.505 . . . . 0.0 110.07 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 153' ' ' LEU . 29.2 mt -65.71 -38.95 90.63 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.487 0.66 . . . . 0.0 110.02 175.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -62.68 -39.39 93.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.225 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 6.6 ttm180 -68.03 -44.32 76.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.929 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.674 ' HA ' HG13 ' B' ' 495' ' ' VAL . 65.8 t80 -51.77 -57.9 7.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.871 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 158' ' ' LEU . 2.6 ptpp? -68.95 -32.4 71.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.2 -36.65 66.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.967 0.413 . . . . 0.0 110.682 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -76.74 -31.37 57.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.702 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -92.97 -4.46 52.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.767 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 60.71 60.31 1.94 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.154 0.502 . . . . 0.0 111.18 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 89.5 mt -91.53 136.22 26.98 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.061 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 25.7 Cg_exo -61.83 125.4 16.5 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.485 2.123 . . . . 0.0 111.861 -178.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.49 ' HB ' HD11 ' A' ' 173' ' ' LEU . 19.5 p . . . . . 0 C--N 1.319 -0.726 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.261 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.49 HD11 ' HB ' ' A' ' 169' ' ' THR . 87.2 mt . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 121.275 0.559 . . . . 0.0 111.764 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.587 ' HB3' ' HG3' ' A' ' 177' ' ' GLN . 26.2 t-20 -137.82 157.93 45.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.412 -178.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.471 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.6 tptm -46.57 -52.75 12.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 122.704 0.402 . . . . 0.0 111.07 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.74 -42.23 98.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 174' ' ' ASN . 21.5 mt-30 -63.09 -38.01 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.231 0.539 . . . . 0.0 110.345 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.654 HD12 HG23 ' A' ' 155' ' ' VAL . 89.0 mt -64.13 -41.64 97.14 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.113 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.54 HG21 ' HA ' ' A' ' 151' ' ' TYR . 80.8 t -62.49 -41.25 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 O-C-N 123.782 0.676 . . . . 0.0 111.001 177.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.77 -51.19 70.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.597 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.96 -46.62 96.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.97 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.51 HG12 HD13 ' A' ' 150' ' ' LEU . 65.4 t -62.45 -49.16 84.98 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.434 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.85 97.3 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.372 -0.442 . . . . 0.0 112.534 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.78 -44.2 97.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.699 0.285 . . . . 0.0 110.75 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -82.13 -29.81 31.46 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.104 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -58.89 -41.16 86.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.103 0.477 . . . . 0.0 110.498 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -77.52 9.45 3.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.503 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -131.4 14.88 5.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.528 0.204 . . . . 0.0 111.483 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.641 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 66.5 mt -80.73 119.29 75.75 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 120.69 0.281 . . . . 0.0 110.997 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.61 124.52 9.37 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.859 2.373 . . . . 0.0 111.118 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.584 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.2 p -142.44 128.46 17.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.458 0.647 . . . . 0.0 112.068 -173.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -98.66 127.55 44.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.128 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 41.7 tt0 -54.5 -60.45 3.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 122.751 0.42 . . . . 0.0 112.13 -175.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -55.17 -57.3 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.89 -174.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -60.59 -44.21 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.622 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 94.9 m -66.13 -41.43 90.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.795 -176.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 49.2 mt -60.19 -45.7 92.22 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 175.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.3 m -61.56 -41.15 96.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.256 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.3 m -62.52 -52.06 64.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.817 178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.566 ' O ' HG23 ' A' ' 204' ' ' VAL . 71.2 t80 -57.98 -57.78 11.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.002 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.606 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 78.6 mt -54.46 -55.16 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -56.8 -40.27 75.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.092 -175.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.9 m -67.44 -48.86 66.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.482 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 200' ' ' PHE . 11.7 t -69.87 -22.55 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 120.936 0.398 . . . . 0.0 110.619 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 10.5 mmm180 . . . . . 0 C--O 1.233 0.217 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.208 173.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.69 0.281 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -59.34 -54.8 42.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.437 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 60.9 m -58.17 -31.53 67.35 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.408 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.5 tt -64.05 -49.69 71.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.683 176.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.496 ' O ' HG23 ' B' ' 471' ' ' VAL . 70.3 t80 -57.05 -56.39 22.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.332 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -62.87 -33.24 74.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -173.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.6 -44.19 82.79 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.068 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.92 -43.44 98.85 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.759 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 467' ' ' PHE . 86.0 t -58.6 -47.67 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 121.038 0.447 . . . . 0.0 110.817 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -39.51 81.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.423 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -76.92 -41.59 42.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.232 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -70.31 -46.02 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.976 -174.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.23 -29.62 67.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.71 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 70.72 -60.43 0.5 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.006 0.816 . . . . 0.0 111.833 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 17.1 t -67.04 127.94 34.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.996 -177.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.03 -23.05 64.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.709 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -75.08 -40.66 59.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.698 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -67.17 -42.26 84.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.228 176.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.513 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 65.4 t80 -65.81 -32.02 73.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.866 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 34.9 tt0 -64.47 -44.58 90.61 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 175.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.81 -44.81 78.21 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 81.9 t80 -55.43 -44.29 76.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.294 0.569 . . . . 0.0 109.978 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.584 ' HB3' HG21 ' A' ' 191' ' ' VAL . 89.3 mt -69.27 -31.19 69.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.354 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.641 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.1 OUTLIER -60.89 -44.06 97.61 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.041 0.448 . . . . 0.0 109.995 173.083 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.0 m -61.23 -36.79 80.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.199 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 45.6 mt -67.48 -47.6 69.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.463 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 14.3 m -65.19 -41.24 91.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.845 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 486' ' ' ARG . 16.1 pt -70.27 -32.94 52.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.944 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -63.68 -44.08 94.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -66.12 -34.01 77.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.533 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -87.79 21.98 2.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.856 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 63.3 25.24 14.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.025 0.441 . . . . 0.0 111.86 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.674 HG13 ' HA ' ' A' ' 161' ' ' TYR . 75.5 t -88.71 -48.47 14.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.34 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 44.1 pt -116.69 160.02 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.463 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.451 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 33.2 m -96.79 -174.0 2.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.18 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.489 ' O ' HG23 ' B' ' 502' ' ' VAL . 20.5 mtp-105 -64.37 -53.35 50.07 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -176.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.21 -48.8 77.89 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -171.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.565 ' HA ' ' HG2' ' B' ' 503' ' ' GLN . 2.5 pm0 -66.29 -32.8 74.42 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.828 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.587 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -58.81 -44.72 90.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.824 0.345 . . . . 0.0 110.487 176.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.507 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.3 OUTLIER -69.82 -41.49 79.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.671 -178.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.565 ' HG2' ' HA ' ' B' ' 500' ' ' GLU . 18.8 pt20 -73.71 -23.33 59.77 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -173.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 153' ' ' LEU . 85.4 mt -66.8 -38.31 86.24 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.954 -0.466 . . . . 0.0 110.905 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.622 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.9 p -89.55 6.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.304 0.573 . . . . 0.0 110.599 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.495 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.5 t -61.14 -46.32 95.99 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.851 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.571 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 48.8 Cg_exo -58.63 -16.37 30.06 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.172 1.915 . . . . 0.0 112.765 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -99.95 -52.76 3.34 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.888 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.736 HD22 HD23 ' B' ' 515' ' ' LEU . 76.8 mt -92.09 0.86 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.634 -175.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.6 -17.17 68.61 Favored Glycine 0 C--O 1.23 -0.156 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.513 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.571 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 3.2 mptp? -90.94 -3.54 57.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.388 0.614 . . . . 0.0 109.46 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 43.4 m-85 -129.0 84.79 61.99 Favored Pre-proline 0 N--CA 1.448 -0.567 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.968 -174.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.95 -49.78 16.4 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.42 2.747 . . . . 0.0 112.893 -173.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.98 -34.03 75.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.385 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.736 HD23 HD22 ' B' ' 509' ' ' LEU . 9.8 tp -78.12 -43.78 27.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.377 -173.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.61 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 52.4 t80 -68.13 -37.31 80.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.091 178.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.42 -34.04 75.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.21 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -59.41 -48.47 81.5 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 175.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.529 ' O ' HD13 ' B' ' 523' ' ' LEU . 3.2 t80 -58.04 -44.03 87.15 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.185 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.61 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 88.7 mttt -60.16 -44.07 95.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.073 175.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -63.87 -39.51 94.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.508 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -70.55 -31.58 68.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.44 0.638 . . . . 0.0 110.045 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.587 HD21 HD23 ' B' ' 501' ' ' LEU . 10.6 mp -88.1 1.19 54.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.924 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 59.25 37.31 91.65 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.025 -178.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . 0.4 ' HD2' ' HG2' ' B' ' 520' ' ' LYS . 19.2 t80 . . . . . 0 C--N 1.322 -0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 110.944 -175.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.7 m . . . . . 0 C--O 1.235 0.296 0 CA-C-O 120.809 0.338 . . . . 0.0 110.473 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.52 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 15.2 Cg_exo -68.59 142.98 55.14 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.823 2.349 . . . . 0.0 111.612 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -100.73 141.32 33.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.6 p -84.44 129.39 37.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 110.561 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.528 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 10.9 t70 -81.31 100.63 9.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.06 3.29 53.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.2 0.524 . . . . 0.0 110.668 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -76.6 -27.63 55.84 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.619 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.0 OUTLIER -51.82 -41.5 61.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.824 171.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.582 HD21 HD11 ' B' ' 504' ' ' LEU . 64.5 mt -61.01 128.19 35.23 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.837 -178.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -62.36 160.86 12.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.521 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.7 -44.18 69.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.122 0.486 . . . . 0.0 110.362 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.59 -37.97 88.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.057 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.408 HG21 HD22 ' A' ' 153' ' ' LEU . 10.6 m -64.35 -45.2 88.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.987 0.422 . . . . 0.0 110.556 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 71.8 mt -59.86 -46.84 88.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.584 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -63.84 -34.94 79.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.84 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' B' ' 494' ' ' GLU . 13.7 ttm180 -66.1 -46.47 77.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.561 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.44 ' HA ' HG13 ' B' ' 495' ' ' VAL . 83.7 t80 -52.52 -48.02 66.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.365 173.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.588 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 6.5 mtpm? -65.46 -34.78 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.427 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -75.27 -40.54 58.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.762 0.315 . . . . 0.0 111.032 -176.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -74.48 -43.71 54.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.804 0.335 . . . . 0.0 111.327 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.439 ' CE1' HG22 ' B' ' 490' ' ' ILE . 39.2 m-85 -85.48 0.24 52.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.353 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 57.39 73.12 0.48 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.433 176.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.588 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 76.0 mt -113.69 135.23 21.95 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.856 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.16 157.4 25.63 Favored 'Trans proline' 0 C--O 1.238 0.476 0 C-N-CA 123.243 2.629 . . . . 0.0 112.381 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.544 ' HB ' HD11 ' A' ' 173' ' ' LEU . 13.8 p . . . . . 0 C--N 1.325 -0.477 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.43 -178.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.544 HD11 ' HB ' ' A' ' 169' ' ' THR . 83.3 mt . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 121.297 0.57 . . . . 0.0 111.748 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.761 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 14.0 m120 -138.54 179.75 6.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.033 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 179' ' ' VAL . 27.7 tptp -57.4 -53.45 58.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.881 0.372 . . . . 0.0 110.798 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.89 -27.84 67.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.295 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.761 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 31.5 mm-40 -67.77 -44.76 76.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.42 0.629 . . . . 0.0 110.154 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 91.2 mt -64.13 -42.71 96.72 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.837 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 175' ' ' LYS . 67.9 t -60.66 -42.41 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.544 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 177' ' ' GLN . 8.0 pt-20 -67.94 -40.85 83.23 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.259 -177.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 180' ' ' GLU . 60.0 mt -67.46 -48.71 76.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 120.916 0.389 . . . . 0.0 110.257 176.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 55.0 t -58.21 -49.05 83.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.706 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.39 96.28 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.546 -177.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 46.7 t -59.05 -46.41 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.969 0.414 . . . . 0.0 110.619 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.77 -26.28 31.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.231 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.494 ' HE1' HD13 ' B' ' 490' ' ' ILE . 35.6 t80 -66.33 -34.85 78.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.176 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -78.33 10.23 3.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.611 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.9 p -136.09 38.82 2.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.948 0.404 . . . . 0.0 111.332 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.89 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 73.8 mt -102.39 115.75 63.98 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.436 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.86 113.22 2.92 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 122.669 2.246 . . . . 0.0 111.918 177.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.603 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.1 p -115.75 154.21 17.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.761 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -118.62 112.89 20.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.561 ' HA ' HD22 ' B' ' 485' ' ' LEU . 32.6 tt0 -51.3 -65.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -58.4 -48.9 79.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.571 0.224 . . . . 0.0 111.356 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.46 -45.76 78.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.837 -174.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . 0.52 ' HB ' HD23 ' B' ' 485' ' ' LEU . 85.3 m -68.7 -37.37 79.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.848 -0.16 . . . . 0.0 110.903 -176.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 53.3 mt -60.73 -47.34 86.75 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 40.7 m -57.91 -47.2 83.52 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.644 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.4 -48.24 82.4 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.57 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.54 ' CG ' HD22 ' B' ' 488' ' ' LEU . 68.8 t80 -64.63 -47.95 76.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.285 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' B' ' 468' ' ' PHE . 78.8 mt -57.44 -44.62 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.021 -177.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -71.07 -35.0 71.73 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.185 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 73.8 m -60.89 -50.23 74.27 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.733 0.301 . . . . 0.0 110.866 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 200' ' ' PHE . 20.4 t -71.48 -33.51 49.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.064 -177.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 . . . . . 0 C--N 1.331 -0.231 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.456 178.256 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.9 p . . . . . 0 N--CA 1.452 -0.366 0 CA-C-O 120.695 0.283 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 50.9 mp0 -62.93 -51.21 67.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.909 177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 17.0 t -63.93 -33.32 75.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.95 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 42.7 tp -58.17 -53.9 53.07 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.169 175.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.451 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.3 t80 -54.03 -55.07 30.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.925 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.473 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.6 m-85 -61.36 -39.5 90.85 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -174.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.8 -39.93 95.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.82 0.343 . . . . 0.0 110.337 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.3 mttt -63.01 -46.25 88.53 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.184 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 467' ' ' PHE . 85.5 t -57.09 -44.47 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.139 0.495 . . . . 0.0 110.521 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -58.43 -42.33 87.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.967 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -80.28 -44.86 18.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.035 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.511 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -61.88 -42.45 99.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' B' ' 477' ' ' SER . 10.6 mp -71.57 -37.95 71.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.217 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 ttp85 70.48 -36.78 0.37 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.976 0.91 . . . . 0.0 111.935 177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . 0.421 ' H ' ' C ' ' B' ' 475' ' ' LEU . 30.1 t -80.51 121.6 25.98 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.901 0.382 . . . . 0.0 110.875 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.95 72.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.706 177.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -63.34 -42.0 98.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.147 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.06 -40.98 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.243 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.548 ' O ' HD12 ' B' ' 485' ' ' LEU . 72.9 t80 -62.51 -45.01 94.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.395 0.617 . . . . 0.0 109.481 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 38.9 tt0 -57.29 -43.94 83.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.038 176.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -56.71 -43.92 81.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.801 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -54.77 -51.44 65.73 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.603 ' HB3' HG21 ' A' ' 191' ' ' VAL . 1.5 mp -66.01 -26.25 67.45 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.89 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.0 mtt85 -68.0 -37.35 81.36 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.801 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 47.6 m -63.08 -32.01 73.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.222 0.534 . . . . 0.0 109.741 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.54 HD22 ' CG ' ' A' ' 200' ' ' PHE . 72.0 mt -68.18 -45.71 72.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.356 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 19.4 m -66.01 -40.89 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.555 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.494 HD13 ' HE1' ' A' ' 186' ' ' PHE . 17.3 pt -69.66 -30.82 46.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -66.32 -42.15 88.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 110.006 174.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.6 -35.58 81.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.561 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -89.62 26.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.019 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . 0.549 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 12.4 pt-20 46.14 32.41 1.43 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.29 1.036 . . . . 0.0 112.649 177.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.478 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 63.8 t -81.76 -42.55 19.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.4 pt -116.13 175.87 2.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 16.3 m -115.15 174.95 5.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.065 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.46 ' O ' HG23 ' B' ' 502' ' ' VAL . 60.8 ttp180 -57.51 -52.39 65.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.506 0.193 . . . . 0.0 110.675 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.5 -46.61 83.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.834 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.8 mm-40 -56.02 -50.44 70.91 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.464 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.518 HD23 HD21 ' B' ' 523' ' ' LEU . 64.3 tp -59.79 -49.0 79.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.405 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.536 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 93.1 t -59.89 -38.52 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.619 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 16.2 mm100 -72.25 -38.91 68.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.413 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.582 HD11 HD21 ' A' ' 153' ' ' LEU . 65.6 mt -58.64 -37.55 76.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.475 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.1 p -91.22 6.01 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.056 0.455 . . . . 0.0 111.4 -175.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.606 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 93.4 p -63.07 -42.17 75.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.606 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 25.8 Cg_exo -65.96 -10.49 27.15 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.88 1.72 . . . . 0.0 112.367 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -99.16 -57.2 2.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.475 ' HG ' HG22 ' B' ' 505' ' ' VAL . 57.3 mt -92.49 3.04 56.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.811 -175.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.59 -22.58 71.67 Favored Glycine 0 N--CA 1.454 -0.12 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.966 -177.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.437 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.7 mptp? -87.37 -2.42 58.6 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.511 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 46.3 m-85 -127.04 90.81 48.44 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.923 -176.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.45 -47.21 20.2 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.35 2.7 . . . . 0.0 113.282 -172.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' B' ' 514' ' ' GLU . 0.0 OUTLIER -72.51 -32.72 66.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.898 0.38 . . . . 0.0 110.918 -176.531 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.473 HD23 HD22 ' B' ' 509' ' ' LEU . 15.8 tp -71.31 -43.74 66.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.072 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.525 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 28.5 t80 -66.61 -34.97 79.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.995 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -63.87 -39.85 95.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.648 175.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -58.1 -49.06 78.25 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.536 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 37.3 t80 -56.67 -45.86 81.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.763 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.525 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.0 mttt -58.87 -39.98 83.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.721 0.296 . . . . 0.0 111.471 178.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -71.22 -38.72 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.304 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -64.61 -45.34 87.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.849 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.518 HD21 HD23 ' B' ' 501' ' ' LEU . 5.6 mp -83.28 -2.72 56.34 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 64.51 52.32 44.28 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.772 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 . . . . . 0 C--N 1.329 -0.319 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.807 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 90.3 m . . . . . 0 C--O 1.233 0.2 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 9.4 Cg_exo -71.35 158.72 53.65 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.252 1.968 . . . . 0.0 110.791 173.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -108.82 145.27 35.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.029 0.443 . . . . 0.0 111.339 -175.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.74 135.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.774 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -105.62 131.99 52.31 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.424 HD13 HG12 ' A' ' 182' ' ' VAL . 96.2 mt -110.28 5.9 22.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.145 0.497 . . . . 0.0 110.471 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -84.99 -24.19 28.36 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 -28.3 69.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.437 172.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.503 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -63.75 158.16 22.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.104 0.478 . . . . 0.0 110.989 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . 0.45 HE21 ' CD ' ' B' ' 500' ' ' GLU . 46.6 mt-30 -78.78 148.95 32.76 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.454 177.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.528 HG13 ' CD1' ' A' ' 178' ' ' LEU . 85.6 t -53.96 -45.29 63.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 CA-C-O 121.198 0.523 . . . . 0.0 110.317 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -60.3 -36.6 78.26 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.631 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 26.7 m -68.23 -43.75 77.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.098 0.475 . . . . 0.0 110.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.401 HD22 HG21 ' A' ' 182' ' ' VAL . 88.0 mt -65.03 -38.54 91.22 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.352 0.596 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 79.9 mtp180 -70.72 -30.59 67.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.309 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.496 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 42.2 ttm105 -70.46 -42.76 71.05 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.651 ' HA ' HG13 ' B' ' 495' ' ' VAL . 52.2 t80 -48.86 -58.2 5.2 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.071 173.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 6.4 ptpp? -67.97 -27.37 66.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.71 -176.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 163' ' ' ARG . 38.7 ttm180 -67.81 -51.62 46.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 177.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -67.31 -37.2 82.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.011 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -88.85 0.15 56.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt 59.69 74.94 0.42 Allowed 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.669 0.606 . . . . 0.0 111.984 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.614 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 82.5 mt -117.6 110.63 40.38 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.96 176.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.08 127.38 16.7 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.672 2.248 . . . . 0.0 112.129 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.547 HG22 HD13 ' A' ' 181' ' ' ILE . 30.7 p . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 120.987 0.422 . . . . 0.0 111.9 -175.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.545 HD11 ' HB ' ' A' ' 169' ' ' THR . 97.9 mt . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.93 0.395 . . . . 0.0 111.061 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.446 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 16.2 t-20 -120.37 167.24 12.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.502 ' HD3' HG22 ' A' ' 155' ' ' VAL . 21.7 tptm -54.38 -52.49 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.555 0.342 . . . . 0.0 111.29 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.48 -36.81 76.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.349 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.826 HE21 ' HA ' ' A' ' 177' ' ' GLN . 0.0 OUTLIER -64.42 -44.01 92.54 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.15 0.5 . . . . 0.0 110.167 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.528 ' CD1' HG13 ' A' ' 155' ' ' VAL . 85.7 mt -62.38 -41.17 98.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.778 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 71.2 t -62.28 -43.98 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 123.622 0.576 . . . . 0.0 111.114 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 48.4 mt-10 -61.05 -44.74 96.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.789 0.328 . . . . 0.0 110.771 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.547 HD13 HG22 ' A' ' 169' ' ' THR . 72.5 mt -63.58 -50.62 77.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.581 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.424 HG12 HD13 ' A' ' 150' ' ' LEU . 69.1 t -61.03 -46.18 97.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.557 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.21 -40.61 99.28 Favored Glycine 0 N--CA 1.448 -0.546 0 O-C-N 123.368 0.417 . . . . 0.0 112.618 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -60.02 -43.31 95.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.358 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -78.87 -28.83 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.597 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.1 -29.98 70.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.537 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -80.75 0.41 34.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.11 176.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.8 t -126.1 24.81 6.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.892 0.377 . . . . 0.0 110.74 -175.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.848 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.4 mt -90.17 117.47 68.07 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.885 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.67 118.79 5.6 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.542 2.161 . . . . 0.0 111.157 174.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.431 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -133.42 154.93 39.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.486 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -132.11 128.25 37.73 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.519 ' HG3' ' HE2' ' B' ' 481' ' ' TYR . 34.7 tt0 -51.98 -63.83 1.01 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.94 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -57.08 -53.74 54.69 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.038 0.447 . . . . 0.0 112.059 -174.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -65.61 -46.6 78.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.911 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.5 m -67.03 -36.7 82.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.375 -176.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 45.0 mt -60.64 -45.86 92.51 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 61.1 m -56.97 -45.54 82.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.741 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 62.5 m -60.08 -54.52 45.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.085 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.549 ' CD1' HD22 ' B' ' 488' ' ' LEU . 71.9 t80 -57.27 -48.29 79.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.278 -177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.487 ' O ' ' HB2' ' A' ' 205' ' ' ARG . 87.8 mt -61.0 -47.23 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.488 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -65.29 -36.45 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.188 -175.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -69.53 -61.22 1.87 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.853 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.22 -29.12 46.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -170.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 201' ' ' ILE . 11.7 mtp180 . . . . . 0 C--N 1.327 -0.386 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 10.0 p . . . . . 0 N--CA 1.451 -0.401 0 CA-C-O 120.632 0.253 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.477 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 0.8 OUTLIER -63.14 -47.46 82.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.096 176.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.6 m -60.24 -39.55 87.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.259 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 44.9 tp -59.08 -51.74 68.76 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.481 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.6 t80 -53.89 -56.96 12.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.739 178.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -64.37 -36.58 84.61 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -173.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.45 -41.92 88.38 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.586 -0.446 . . . . 0.0 109.965 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . 0.401 ' HD2' HD13 ' B' ' 515' ' ' LEU . 38.9 ttmt -62.38 -43.95 97.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.067 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.648 HG13 HD21 ' B' ' 509' ' ' LEU . 86.7 t -59.96 -51.91 67.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.16 0.505 . . . . 0.0 110.782 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -58.7 -34.1 70.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.202 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . 0.448 ' HB2' ' HE3' ' B' ' 473' ' ' LYS . 36.9 ttmt -85.19 -31.93 22.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.511 -176.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.89 -39.6 30.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.644 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' B' ' 477' ' ' SER . 66.0 mt -62.91 -35.65 80.77 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.934 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 476' ' ' ARG . 35.4 ttt180 71.81 -28.58 0.19 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.818 0.699 . . . . 0.0 111.836 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . 0.455 ' H ' ' C ' ' B' ' 475' ' ' LEU . 1.2 p -96.09 120.39 36.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.058 -177.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.72 99.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -60.51 -35.16 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.084 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.51 -36.8 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 0.0 110.734 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.519 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 44.0 t80 -71.69 -34.57 69.76 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 42.6 tt0 -62.62 -43.03 99.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.709 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.67 -48.58 69.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.705 174.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.447 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 83.9 t80 -55.11 -48.73 73.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.525 176.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 95.3 mt -64.53 -32.21 73.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.644 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.848 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.6 mtt180 -68.89 -38.22 79.51 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.483 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.3 -35.49 75.71 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.013 0.435 . . . . 0.0 109.931 172.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.549 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -65.57 -52.19 54.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.067 179.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.529 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -61.81 -39.63 84.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.1 pt -69.83 -31.04 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.652 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -67.29 -38.22 84.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 109.97 171.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . 0.437 HD21 ' HA ' ' A' ' 200' ' ' PHE . 13.4 m120 -72.79 -5.2 36.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.459 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -115.14 13.39 16.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.154 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 59.29 29.33 18.87 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.472 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.651 HG13 ' HA ' ' A' ' 161' ' ' TYR . 71.4 t -80.59 -51.03 16.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.1 0.476 . . . . 0.0 110.333 178.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.5 pt -108.51 167.15 4.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.15 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 27.0 t -101.34 177.75 4.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.949 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.568 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 52.5 ttp180 -59.01 -59.46 5.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.179 0.514 . . . . 0.0 110.685 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -57.35 -40.98 79.21 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.565 -179.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.537 ' HA ' ' NE2' ' B' ' 503' ' ' GLN . 8.8 mm-40 -55.45 -42.81 74.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.103 0.477 . . . . 0.0 110.213 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 10.5 tt -64.84 -45.8 84.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.33 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.533 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.1 OUTLIER -64.19 -32.51 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.516 -179.239 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.537 ' NE2' ' HA ' ' B' ' 500' ' ' GLU . 16.7 mt-30 -68.12 -43.13 79.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.145 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.503 HD21 HD21 ' A' ' 153' ' ' LEU . 49.3 mt -58.72 -43.51 90.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.106 -177.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.537 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -91.58 7.91 4.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.15 0.5 . . . . 0.0 111.038 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.578 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 20.6 t -59.5 -49.49 92.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.927 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 47.3 Cg_exo -59.68 -17.17 40.94 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.256 1.971 . . . . 0.0 112.898 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -95.9 -57.32 2.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.351 -175.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.663 HD22 HD23 ' B' ' 515' ' ' LEU . 53.2 mt -99.26 -9.4 23.68 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -173.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.16 -23.07 71.27 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.527 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -78.78 -5.1 52.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.667 178.276 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.403 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 65.9 m-85 -122.12 92.46 48.87 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.783 177.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 7.7 Cg_endo -49.64 -48.0 20.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.606 2.871 . . . . 0.0 113.268 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.84 -34.41 77.87 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.088 0.471 . . . . 0.0 111.095 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.663 HD23 HD22 ' B' ' 509' ' ' LEU . 12.9 tp -78.44 -43.8 26.31 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.016 -174.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.533 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 11.8 t80 -69.75 -32.27 70.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.853 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' B' ' 520' ' ' LYS . 25.5 t-20 -66.33 -37.68 85.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.309 175.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.477 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 27.2 t90 -58.02 -46.98 84.41 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -38.5 87.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.93 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 516' ' ' PHE . 34.0 mmtp -53.27 -50.52 64.67 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.335 0.588 . . . . 0.0 110.168 174.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.54 -36.27 78.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.86 -175.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -72.78 -39.32 66.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.543 -174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.568 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 10.6 mp -81.53 -19.58 41.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.934 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 74.08 28.22 64.83 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.829 -0.908 . . . . 0.0 110.829 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 36.9 t80 . . . . . 0 N--CA 1.451 -0.403 0 CA-C-O 121.171 0.51 . . . . 0.0 110.284 -175.628 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.2 m . . . . . 0 C--O 1.233 0.193 0 N-CA-C 109.773 -0.455 . . . . 0.0 109.773 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.472 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 11.4 Cg_exo -69.68 155.18 66.88 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.711 2.274 . . . . 0.0 111.686 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -107.59 163.91 12.67 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.718 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.8 p -119.85 121.37 65.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.205 0.526 . . . . 0.0 110.819 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -74.2 118.61 17.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.073 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 62.5 mt -106.72 -6.9 17.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.96 0.41 . . . . 0.0 110.841 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.491 ' HA ' HG21 ' A' ' 179' ' ' VAL . 1.9 t80 -75.21 -14.29 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.393 0.615 . . . . 0.0 109.345 176.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.27 -24.64 59.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.9 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.696 HD21 HD21 ' B' ' 504' ' ' LEU . 29.7 mt -68.58 160.25 30.38 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.26 0.552 . . . . 0.0 111.42 -173.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.12 156.24 30.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.094 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.46 HG13 ' CD1' ' A' ' 178' ' ' LEU . 50.2 t -58.92 -44.27 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -56.97 -44.54 82.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.671 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.722 HG21 ' HG2' ' B' ' 500' ' ' GLU . 35.8 m -62.93 -48.38 79.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.112 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 95.5 mt -63.28 -44.61 94.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 50.5 mtp180 -65.18 -35.88 82.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.615 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -68.14 -43.82 77.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.612 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -53.26 -50.0 65.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.074 0.464 . . . . 0.0 110.302 174.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.566 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 59.7 mtpt -67.83 -29.02 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.615 -177.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.416 ' O ' ' HD3' ' A' ' 166' ' ' LYS . 44.6 ttm180 -79.72 -43.64 22.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.629 0.252 . . . . 0.0 111.024 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -69.15 -42.66 75.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.737 0.304 . . . . 0.0 110.631 -177.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -84.28 -1.31 55.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.53 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 163' ' ' ARG . 71.7 mmtt 58.35 66.74 1.04 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.464 178.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.523 HD13 HG22 ' A' ' 181' ' ' ILE . 94.6 mt -101.18 137.31 19.66 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.499 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.34 139.63 78.23 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.825 2.35 . . . . 0.0 111.953 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 37.6 p . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.803 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 88.0 mt . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 121.362 0.601 . . . . 0.0 111.183 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.631 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 17.8 m120 -137.14 176.35 8.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.015 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -55.84 -48.73 74.97 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.386 0.429 . . . . 0.0 110.698 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.11 93.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.248 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.631 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 27.9 mm-40 -60.76 -40.42 92.43 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.454 0.645 . . . . 0.0 110.644 -178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 81.7 mt -63.61 -51.88 63.33 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.745 177.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.491 HG21 ' HA ' ' A' ' 151' ' ' TYR . 96.7 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 123.622 0.576 . . . . 0.0 111.695 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.52 -49.18 77.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.465 -178.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.566 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 65.8 mt -70.6 -42.88 78.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 -179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 178' ' ' LEU . 56.0 t -59.26 -49.38 83.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.389 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.426 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.68 -37.54 94.51 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.424 -0.417 . . . . 0.0 112.661 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.9 t -57.9 -43.05 85.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.912 0.387 . . . . 0.0 110.586 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -86.65 -27.59 23.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.832 0.348 . . . . 0.0 111.17 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.471 ' HE1' HD13 ' B' ' 490' ' ' ILE . 50.3 t80 -61.77 -42.73 99.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 -176.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -78.19 17.94 0.57 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 34.9 p -140.59 19.72 2.36 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.457 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.985 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 81.6 mt -78.7 124.03 85.25 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.96 140.55 42.18 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.252 1.968 . . . . 0.0 110.907 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.95 155.78 6.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.919 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -125.32 115.17 19.92 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.3 tt0 -47.78 -64.76 0.7 Allowed 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -172.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -64.7 -45.84 84.91 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -173.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.24 -41.54 89.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.769 0.319 . . . . 0.0 110.92 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.5 m -66.13 -40.16 90.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.917 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 50.0 mt -58.82 -46.68 87.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 55.8 m -56.04 -48.81 75.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.741 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 60.3 m -57.21 -55.23 37.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.236 177.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.637 ' CD1' HD22 ' B' ' 488' ' ' LEU . 41.6 t80 -52.03 -52.94 47.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.562 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.541 HD11 ' HE2' ' B' ' 468' ' ' PHE . 84.4 mt -56.71 -55.35 20.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.248 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.21 -29.74 63.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -173.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -63.81 -55.27 24.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.343 176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD23 ' B' ' 523' ' ' LEU . 58.2 t -65.18 -32.21 57.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.637 -175.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.452 ' HD3' HG22 ' A' ' 201' ' ' ILE . 23.8 mtp180 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 112.168 179.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.0 p . . . . . 0 N--CA 1.45 -0.444 0 CA-C-O 120.901 0.382 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.475 ' HA ' ' CH2' ' B' ' 518' ' ' TRP . 3.4 mp0 -58.78 -43.53 90.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.752 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 15.9 m -63.57 -33.01 74.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.003 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 54.8 tp -65.59 -43.25 90.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.21 0.528 . . . . 0.0 109.862 177.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.452 ' O ' HG23 ' B' ' 471' ' ' VAL . 64.6 t80 -54.96 -49.19 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.994 173.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.1 m-85 -66.18 -32.07 73.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.77 -177.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.91 -46.31 91.17 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -60.91 -49.08 78.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.834 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 467' ' ' PHE . 92.5 t -59.49 -51.71 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.841 0.353 . . . . 0.0 111.345 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -58.97 -41.68 88.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.519 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' B' ' 473' ' ' LYS . 21.9 ttmt -75.77 -34.35 60.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.317 -175.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.82 -41.27 26.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.716 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.56 -41.96 87.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 121.101 -0.239 . . . . 0.0 110.831 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' B' ' 476' ' ' ARG . 40.2 ttt180 70.6 -56.12 0.61 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.847 0.717 . . . . 0.0 111.688 176.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 28.4 t -65.89 129.62 40.4 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.082 -179.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.02 -40.95 87.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.946 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.88 -31.11 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 0.0 110.054 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.472 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.64 -43.51 65.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 177.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.491 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 76.8 t80 -65.54 -39.67 91.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 176.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.5 tt0 -60.09 -43.56 95.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.847 174.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.11 -44.7 75.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.821 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.472 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 51.2 t80 -57.53 -48.52 79.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.312 175.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 193' ' ' GLU . 87.2 mt -63.91 -33.1 74.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.171 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.985 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 20.0 mtt85 -66.12 -38.17 87.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.928 0.394 . . . . 0.0 110.452 177.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 53.7 m -62.03 -34.34 76.05 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 173.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.637 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -68.11 -46.85 69.78 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.412 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.498 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.6 m -64.85 -42.57 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.634 -178.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.471 HD13 ' HE1' ' A' ' 186' ' ' PHE . 22.9 pt -69.51 -29.59 42.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.848 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.33 -42.47 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.105 0.479 . . . . 0.0 109.889 172.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -67.26 -32.57 73.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.965 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.53 7.8 16.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 65.62 21.8 11.68 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.371 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.459 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 95.2 t -75.5 -43.07 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.973 0.416 . . . . 0.0 110.096 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.53 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 36.2 pt -120.17 154.96 23.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.717 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 28.3 p -98.99 -171.3 2.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.292 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.567 ' O ' HG23 ' B' ' 502' ' ' VAL . 45.2 ttp180 -55.77 -42.12 75.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.419 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -60.23 -53.4 58.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.571 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.722 ' HG2' HG21 ' A' ' 157' ' ' THR . 2.3 mp0 -60.63 -41.72 95.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.78 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.51 -41.99 86.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.763 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.567 HG23 ' O ' ' B' ' 498' ' ' ARG . 67.3 t -69.4 -40.71 80.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.894 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -74.68 -41.65 59.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.176 -175.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.696 HD21 HD21 ' A' ' 153' ' ' LEU . 91.0 mt -61.26 -36.92 81.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 111.636 -175.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -92.16 6.81 5.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.969 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.526 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 34.9 t -59.77 -48.33 95.37 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.737 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.526 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 24.0 Cg_exo -66.3 -1.56 5.69 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.946 1.764 . . . . 0.0 112.731 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.65 -61.68 1.61 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.764 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' B' ' 505' ' ' VAL . 48.1 mt -89.35 -21.16 23.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.151 -175.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -70.44 -10.18 66.02 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.452 -177.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -79.9 -11.83 59.78 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.463 ' HB2' ' HB3' ' B' ' 515' ' ' LEU . 60.5 m-85 -124.95 104.33 30.0 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.054 -178.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.13 -50.45 13.36 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.523 2.815 . . . . 0.0 113.586 -175.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -66.51 -41.47 88.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.095 0.474 . . . . 0.0 110.665 -177.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 22.2 tp -67.0 -45.71 76.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.727 -175.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -67.28 -32.34 73.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.351 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.15 -47.49 79.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.463 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.475 ' CH2' ' HA ' ' B' ' 464' ' ' GLU . 4.9 t90 -57.16 -48.56 78.4 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.753 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.516 ' CZ ' HD11 ' B' ' 523' ' ' LEU . 39.5 t80 -56.82 -50.69 71.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.495 -178.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.2 -38.29 90.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.2 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -44.42 91.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.586 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -63.03 -41.38 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.633 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.573 HD23 HG11 ' A' ' 204' ' ' VAL . 88.7 mt -71.08 -26.64 63.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.489 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.55 33.87 15.32 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -173.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 . . . . . 0 N--CA 1.449 -0.501 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.444 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.1 m . . . . . 0 N--CA 1.452 -0.344 0 N-CA-C 110.303 -0.258 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 53.7 Cg_exo -54.09 147.94 41.77 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.699 2.266 . . . . 0.0 112.131 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -126.64 149.72 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.122 0.487 . . . . 0.0 111.111 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.626 HG21 HD21 ' B' ' 483' ' ' ASN . 0.8 OUTLIER -95.47 138.73 20.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.915 -175.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.46 -46.87 68.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.831 0.824 . . . . 0.0 109.787 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.583 HD23 HD22 ' B' ' 504' ' ' LEU . 40.2 mt 60.28 10.04 2.2 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.527 -1.67 . . . . 0.0 111.553 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -94.03 -10.96 31.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -70.39 -29.95 66.72 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.584 HD21 HD21 ' B' ' 504' ' ' LEU . 19.2 mt -59.31 131.62 51.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.219 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -72.29 163.61 27.67 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.914 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.54 -44.17 80.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.758 0.313 . . . . 0.0 110.744 -178.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 24.8 p30 -61.77 -35.43 78.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 48.1 m -71.78 -46.84 57.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.693 0.282 . . . . 0.0 110.97 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.654 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 88.1 mt -60.84 -46.82 89.05 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.226 0.536 . . . . 0.0 110.46 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.462 ' HA ' ' HD3' ' A' ' 162' ' ' LYS . 29.5 mtp180 -65.12 -31.83 73.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.677 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 156' ' ' ASN . 39.3 ttm180 -67.24 -46.81 72.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.266 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -52.94 -49.76 65.36 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.025 0.44 . . . . 0.0 110.335 174.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 159' ' ' ARG . 7.9 mtpm? -57.7 -45.35 85.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.881 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -81.91 -31.7 31.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.514 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . 0.531 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 45.4 t-80 -72.57 -37.99 68.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.556 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -88.41 -8.07 55.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.239 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm 61.33 69.99 0.63 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.766 0.666 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 84.9 mt -105.93 145.15 30.34 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.233 -178.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 21.5 Cg_exo -65.68 150.73 86.03 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.182 2.588 . . . . 0.0 111.928 176.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 18.7 p . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.092 0.473 . . . . 0.0 112.115 -175.198 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 85.6 mt . . . . . 0 C--O 1.231 0.112 0 CA-C-O 121.136 0.493 . . . . 0.0 111.314 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.732 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 26.9 m-80 -141.66 177.34 8.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.589 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -56.78 -52.11 66.32 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.182 0.301 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.9 -30.03 69.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.736 0.303 . . . . 0.0 110.847 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.732 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 25.4 mm-40 -64.58 -42.54 95.56 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.146 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 75.3 mt -62.72 -46.97 85.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.056 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.79 -46.03 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.281 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -60.1 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.45 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.2 -49.54 80.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.6 t -59.13 -49.47 83.24 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.91 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.31 92.12 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 121.49 -0.386 . . . . 0.0 112.835 -176.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.48 -48.97 79.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -80.77 -26.14 37.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.034 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.503 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.9 t80 -57.28 -48.59 78.52 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 -179.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.9 45.95 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 0.0 111.417 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 61.7 m -152.02 11.38 0.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.196 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.792 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 79.1 mt -89.34 120.93 69.75 Favored Pre-proline 0 C--O 1.234 0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.619 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 8.1 Cg_exo -72.08 148.07 49.86 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.836 2.357 . . . . 0.0 111.732 177.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.26 129.8 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 0.0 111.327 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 195' ' ' ASP . 26.5 t-20 -91.44 119.63 31.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 169.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 42.4 tt0 -51.63 -54.17 30.72 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.388 0.43 . . . . 0.0 111.474 -173.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -59.24 -51.47 69.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . 0.4 ' HB3' ' HB3' ' A' ' 192' ' ' ASN . 38.4 t70 -62.85 -43.94 97.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.328 -176.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . 0.437 HG21 ' HB3' ' B' ' 485' ' ' LEU . 19.9 m -66.34 -42.69 87.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.299 -176.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 80.3 mt -62.98 -41.82 99.66 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 28.3 m -57.46 -46.23 83.87 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.375 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 95.0 m -56.87 -56.19 24.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.478 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.53 ' CG ' HD22 ' B' ' 488' ' ' LEU . 56.1 t80 -62.72 -55.5 26.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.603 -175.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 67.4 mt -56.43 -55.67 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.231 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.89 -34.82 78.62 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -173.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -64.99 -51.63 60.65 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.724 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD12 ' B' ' 523' ' ' LEU . 44.4 t -68.92 -28.72 40.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 120.986 0.422 . . . . 0.0 111.05 174.551 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.452 -0.359 0 CA-C-O 120.634 0.254 . . . . 0.0 110.608 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.473 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -63.58 -38.66 91.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.833 0.349 . . . . 0.0 110.627 177.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 9.9 m -59.26 -43.71 92.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.244 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.73 -48.42 81.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.896 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.2 t80 -53.48 -52.9 58.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.06 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.467 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.0 m-85 -70.18 -28.93 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -174.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.21 -40.79 82.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -57.95 -50.27 73.95 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.368 172.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 467' ' ' PHE . 84.1 t -54.51 -42.23 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.869 0.366 . . . . 0.0 110.976 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -54.93 -51.57 65.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.313 177.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -78.46 -33.23 48.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.834 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.722 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -70.37 -45.84 65.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.75 -30.67 68.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.679 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' B' ' 474' ' ' ALA . 13.3 mtp180 68.94 -51.95 0.58 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.683 0.793 . . . . 0.0 112.427 173.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.4 t -78.77 137.8 37.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.882 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.98 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.594 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.12 -38.77 91.72 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.525 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.16 -47.3 74.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.975 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.467 ' CE2' HD11 ' B' ' 485' ' ' LEU . 91.3 t80 -65.62 -42.92 91.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.543 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.1 tt0 -59.43 -40.81 87.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.676 177.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.626 HD21 HG21 ' A' ' 148' ' ' VAL . 3.0 t30 -57.93 -47.61 82.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.686 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -51.73 -49.91 61.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.95 174.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.467 HD11 ' CE2' ' B' ' 481' ' ' TYR . 71.7 mt -63.05 -34.37 77.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.22 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.792 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.2 mtt85 -66.52 -36.54 82.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 51.4 m -61.44 -36.42 80.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.23 0.538 . . . . 0.0 109.657 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 61.9 mt -66.11 -47.74 73.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.569 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.576 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.5 m -65.77 -42.16 91.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -176.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.474 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 22.7 pt -68.48 -31.39 51.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.601 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.18 -42.02 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.291 0.567 . . . . 0.0 110.02 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -65.95 -31.36 72.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.759 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 77.1 mt-30 -90.39 15.03 11.36 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.552 -177.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 68.75 10.93 8.17 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.128 0.571 . . . . 0.0 112.226 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.474 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 90.0 t -68.85 -55.51 15.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.089 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.419 HG12 HG13 ' B' ' 490' ' ' ILE . 42.3 pt -111.83 152.45 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.436 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 58.2 m -102.5 -177.28 3.35 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.784 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.574 ' O ' HG23 ' B' ' 502' ' ' VAL . 40.2 ttp180 -57.25 -45.94 83.5 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.643 -175.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.89 -51.03 71.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.776 0.322 . . . . 0.0 111.036 -178.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.7 mp0 -60.21 -44.33 95.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 179.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.47 -46.85 80.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.067 0.461 . . . . 0.0 110.955 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 498' ' ' ARG . 88.5 t -63.1 -35.91 73.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.883 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -77.56 -30.02 52.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.584 HD21 HD21 ' A' ' 153' ' ' LEU . 86.2 mt -71.21 -39.72 71.58 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.29 7.1 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.255 0.55 . . . . 0.0 110.864 -177.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.641 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 31.7 t -57.95 -52.75 72.16 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.721 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.0 Cg_exo -66.67 -3.39 9.16 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.286 1.991 . . . . 0.0 112.931 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.583 ' CZ ' HG22 ' A' ' 148' ' ' VAL . 95.8 m-85 -109.27 -53.78 2.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.425 -175.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.586 HD22 HD23 ' B' ' 515' ' ' LEU . 87.1 mt -107.1 -6.42 17.41 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -176.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.03 -15.61 69.71 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.006 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' B' ' 512' ' ' PHE . 0.0 OUTLIER -84.75 1.97 44.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.523 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.722 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 87.9 m-85 -128.54 93.33 38.29 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.853 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.0 Cg_endo -52.55 -54.08 5.78 Favored 'Trans proline' 0 CA--C 1.528 0.198 0 C-N-CA 123.537 2.825 . . . . 0.0 113.345 -173.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -66.94 -33.26 75.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 0.0 111.207 -176.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.586 HD23 HD22 ' B' ' 509' ' ' LEU . 16.3 tp -74.84 -39.16 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 110.26 -178.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -70.15 -30.31 67.43 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 176.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.31 -45.19 95.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.851 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.473 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 19.0 t90 -56.23 -48.41 76.54 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.744 176.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -47.04 76.99 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.537 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.2 -39.82 91.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -66.46 -37.36 84.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.047 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -71.86 -35.12 69.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.112 0.482 . . . . 0.0 110.395 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.573 HD12 HG11 ' A' ' 204' ' ' VAL . 5.2 mp -86.92 -7.15 58.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.492 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.72 40.27 97.84 Favored Glycine 0 N--CA 1.452 -0.248 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 -175.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 45.5 t80 . . . . . 0 C--N 1.326 -0.427 0 CA-C-O 121.1 0.476 . . . . 0.0 110.675 -173.408 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 86.8 m . . . . . 0 CA--C 1.529 0.172 0 N-CA-C 110.207 -0.294 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 4.5 Cg_exo -74.29 165.22 32.34 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.628 2.218 . . . . 0.0 111.394 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -120.66 152.62 37.96 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.958 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.17 124.83 53.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.136 0.493 . . . . 0.0 110.957 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -81.65 107.06 14.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.772 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.5 mt -91.96 5.27 50.71 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.831 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -80.47 -17.44 51.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -64.68 -27.42 68.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.619 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.536 HD21 HD11 ' B' ' 504' ' ' LEU . 52.1 mt -69.98 142.69 52.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.036 -176.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -70.5 158.14 36.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.073 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.5 t -58.29 -43.1 85.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 110.145 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.99 -40.05 91.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.344 178.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 16.6 m -65.89 -42.8 89.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.107 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 91.8 mt -65.06 -42.01 94.62 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.978 0.418 . . . . 0.0 110.814 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.42 -35.93 82.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.977 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.7 ttm180 -63.66 -39.94 95.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.085 -179.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.465 ' HA ' HG13 ' B' ' 495' ' ' VAL . 54.3 t80 -60.51 -52.27 65.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.544 173.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.636 ' HG2' HD12 ' A' ' 167' ' ' LEU . 19.9 mtpp -66.35 -28.69 68.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.069 -175.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -80.04 -39.52 29.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.092 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -70.64 -40.67 72.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.597 0.237 . . . . 0.0 111.232 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -88.6 -0.4 57.22 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.493 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 55.99 82.37 0.11 Allowed 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.677 0.61 . . . . 0.0 111.922 176.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.636 HD12 ' HG2' ' A' ' 162' ' ' LYS . 93.2 mt -114.53 134.1 22.4 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.478 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.61 127.81 7.43 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.527 2.152 . . . . 0.0 112.254 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 10.6 t . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.258 178.984 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 64.2 mt . . . . . 0 N--CA 1.455 -0.18 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.981 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 16.7 m120 -80.21 168.21 19.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.773 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.668 ' O ' HG23 ' A' ' 179' ' ' VAL . 17.8 tptm -55.88 -54.52 43.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.519 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.02 73.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.981 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 5.8 mm100 -69.22 -40.85 77.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.013 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 94.5 mt -59.83 -44.66 93.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.883 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 175' ' ' LYS . 37.6 t -57.67 -43.05 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.067 -178.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.03 -48.43 78.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.1 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.93 -46.27 96.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 CA-C-O 120.947 0.403 . . . . 0.0 110.687 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.7 t -59.39 -48.6 86.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.368 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.409 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -58.82 -46.76 93.05 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.376 -0.44 . . . . 0.0 112.714 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.98 -45.64 78.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.928 0.394 . . . . 0.0 111.231 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -79.48 -29.96 41.88 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.923 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.0 t80 -63.47 -43.47 97.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.787 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -68.07 -15.58 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 111.198 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 m -99.33 10.18 41.91 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.566 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.2 mt -83.26 118.98 73.23 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-O 120.651 0.262 . . . . 0.0 111.185 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.09 114.2 3.54 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.104 2.536 . . . . 0.0 110.925 173.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.03 138.28 52.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.128 0.49 . . . . 0.0 111.241 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -100.28 142.15 32.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.855 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.69 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.7 tt0 -63.59 -64.32 0.93 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . 0.404 ' C ' ' HD3' ' A' ' 194' ' ' LYS . 1.0 OUTLIER -64.43 -50.08 68.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.19 -171.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -55.62 -39.75 71.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.468 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 37.1 m -75.3 -36.81 61.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.072 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 21.8 mt -60.29 -48.13 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 176.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 63.6 m -59.19 -42.67 91.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 68.5 m -56.54 -55.79 29.41 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.187 0.518 . . . . 0.0 111.696 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.722 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 46.6 t80 -63.44 -48.03 79.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.109 -176.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 82.6 mt -57.61 -52.82 52.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -58.59 -37.67 76.31 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 33.1 m -60.66 -52.26 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.884 0.373 . . . . 0.0 110.74 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 18.9 t -76.54 -24.5 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.915 -174.117 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.41 ' HE ' ' HA ' ' A' ' 205' ' ' ARG . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.413 . . . . 0.0 110.978 177.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 2.8 p . . . . . 0 N--CA 1.456 -0.167 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -61.17 -40.33 93.51 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.098 0.408 . . . . 0.0 111.063 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 68.4 m -63.12 -34.05 76.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.906 0.384 . . . . 0.0 110.486 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.64 -47.45 69.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.583 ' O ' HG23 ' B' ' 471' ' ' VAL . 74.9 t80 -52.59 -59.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.427 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.722 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 58.6 m-85 -63.55 -39.37 94.24 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -174.189 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.79 -41.41 95.84 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.991 0.424 . . . . 0.0 110.186 177.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.2 -42.32 93.66 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.326 178.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.583 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.9 t -60.67 -51.35 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-O 120.955 0.407 . . . . 0.0 110.204 175.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -55.04 -34.85 63.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.454 -177.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -87.06 -51.03 6.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.818 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -71.39 -25.54 62.4 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -172.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' B' ' 475' ' ' LEU . 12.1 tp -70.44 -19.76 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 2.4 tmt_? 73.59 -43.39 0.55 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 124.071 0.857 . . . . 0.0 111.497 173.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 26.1 t -97.99 125.15 42.79 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.939 0.399 . . . . 0.0 111.273 -177.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -70.76 -27.8 64.2 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.806 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' B' ' 479' ' ' GLU . 2.6 mp0 -65.16 -44.24 89.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.604 176.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.589 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -65.25 -40.0 93.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.599 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.842 176.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.458 ' HG2' ' HE ' ' B' ' 486' ' ' ARG . 27.5 tt0 -58.57 -44.21 89.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.251 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.45 -40.95 98.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.699 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.65 -47.56 81.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.31 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 83.3 mt -66.07 -30.55 71.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.028 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.624 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.9 mtm105 -68.92 -38.31 79.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.804 0.335 . . . . 0.0 110.793 176.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 55.8 m -60.74 -34.09 73.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.195 0.521 . . . . 0.0 109.857 171.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.543 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.8 mt -69.11 -45.62 69.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.917 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.545 HG22 ' HA ' ' B' ' 486' ' ' ARG . 24.3 m -62.9 -44.6 99.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.102 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 43.6 pt -67.1 -30.46 49.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.941 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -62.27 -45.09 94.84 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.185 0.517 . . . . 0.0 110.31 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -73.33 -29.23 62.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.079 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -81.6 12.77 3.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.448 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 64.52 27.58 13.41 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.032 0.444 . . . . 0.0 111.148 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.571 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.6 t -87.66 -46.85 15.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.653 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.0 pt -120.02 160.96 19.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.231 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.405 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.8 t -100.77 178.44 4.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.104 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.595 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 35.1 ttp180 -54.44 -52.39 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -50.97 -52.91 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.66 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.449 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.2 mp0 -58.29 -47.41 83.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.999 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.6 tp -55.29 -45.64 76.21 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.071 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.562 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 58.2 t -63.52 -38.54 82.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.965 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -74.99 -38.22 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.685 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.536 HD11 HD21 ' A' ' 153' ' ' LEU . 90.1 mt -62.33 -37.16 84.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.785 0.326 . . . . 0.0 111.813 -176.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.454 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -88.78 2.77 6.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.03 0.443 . . . . 0.0 111.183 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.539 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 28.2 t -59.07 -49.23 94.27 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.084 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 51.5 Cg_exo -55.91 -23.93 45.28 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 121.785 1.657 . . . . 0.0 112.571 176.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -87.88 -64.57 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.029 -177.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.668 HD22 HD23 ' B' ' 515' ' ' LEU . 64.7 mt -89.47 3.07 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.785 -172.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.43 -27.46 70.84 Favored Glycine 0 N--CA 1.453 -0.174 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.488 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -87.02 1.35 53.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.754 0.311 . . . . 0.0 110.801 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -125.3 85.5 58.27 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.971 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.19 -54.88 3.99 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.154 2.569 . . . . 0.0 113.56 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -62.88 -31.88 73.02 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 111.376 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.668 HD23 HD22 ' B' ' 509' ' ' LEU . 20.9 tp -76.67 -42.04 43.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.281 0.562 . . . . 0.0 110.218 -177.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.441 ' HD1' ' HB2' ' B' ' 509' ' ' LEU . 32.1 t80 -70.97 -34.37 71.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.092 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -71.58 -30.51 65.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.724 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -61.44 -48.1 82.68 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.562 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 34.6 t80 -54.96 -43.24 73.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.357 177.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.422 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.3 mttt -62.52 -46.46 88.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.109 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -60.36 -42.17 95.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.756 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -66.7 -41.21 88.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 -176.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.595 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 9.5 mp -82.75 -4.6 58.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.667 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 63.88 37.18 94.28 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.261 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 60.1 t80 . . . . . 0 N--CA 1.448 -0.54 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.084 -175.764 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.5 m . . . . . 0 C--O 1.233 0.216 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.426 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 45.0 Cg_endo -73.49 155.39 50.4 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 121.893 1.729 . . . . 0.0 110.845 174.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -129.58 157.4 42.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.903 0.382 . . . . 0.0 111.246 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.405 HG11 ' CE2' ' A' ' 186' ' ' PHE . 4.1 p -97.42 125.11 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.726 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 151' ' ' TYR . 18.4 p-10 -94.43 96.62 9.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.344 0.593 . . . . 0.0 109.756 176.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.689 HD23 HD11 ' B' ' 504' ' ' LEU . 92.6 mt -71.48 25.27 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.435 ' CD1' HG21 ' A' ' 179' ' ' VAL . 3.3 t80 -96.57 -4.81 40.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 120.958 0.409 . . . . 0.0 109.994 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.65 -24.14 29.17 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.715 HD21 HD13 ' B' ' 504' ' ' LEU . 79.4 mt -62.63 135.52 57.42 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.231 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -74.98 163.26 27.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.405 177.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.91 -35.73 41.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.49 -44.89 95.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.767 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.449 HG23 ' HA ' ' B' ' 496' ' ' ILE . 8.4 m -69.65 -42.41 74.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.085 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.8 mt -61.25 -43.46 98.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.394 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -66.17 -34.86 78.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.74 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.673 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 34.7 ttm180 -68.16 -45.75 72.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.14 -178.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.41 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 48.4 t80 -52.89 -51.6 60.57 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.474 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 10.2 mtpm? -59.95 -38.83 83.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.024 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -76.66 -44.97 31.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.242 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -70.04 -30.9 68.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.601 0.238 . . . . 0.0 111.002 -176.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.528 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 62.6 m-85 -96.15 0.3 51.08 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.185 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.61 75.22 0.34 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.741 0.651 . . . . 0.0 111.846 178.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 89.2 mt -110.18 106.82 58.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.906 177.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 32.0 Cg_endo -65.26 125.7 15.01 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.347 2.031 . . . . 0.0 111.784 -178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.525 HG21 HD13 ' A' ' 181' ' ' ILE . 20.3 p . . . . . 0 C--N 1.324 -0.506 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.98 -175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.9 mt . . . . . 0 C--O 1.235 0.306 0 CA-C-O 121.138 0.494 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.783 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 16.3 t-20 -145.3 169.08 18.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.47 ' HE3' ' O ' ' A' ' 153' ' ' LEU . 22.3 tptm -50.66 -49.64 56.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.751 0.31 . . . . 0.0 110.4 176.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -63.24 -40.43 97.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.119 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.783 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 62.3 mm-40 -62.57 -46.92 86.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.551 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 83.1 mt -61.21 -43.22 99.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.537 -178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.435 HG21 ' CD1' ' A' ' 151' ' ' TYR . 57.1 t -60.37 -43.34 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.221 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.9 mt-10 -64.18 -41.75 96.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.906 0.384 . . . . 0.0 110.954 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.525 HD13 HG21 ' A' ' 169' ' ' THR . 81.3 mt -68.65 -50.88 51.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.822 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.554 HG12 HD13 ' A' ' 150' ' ' LEU . 77.9 t -58.44 -45.69 89.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.082 177.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' A' ' 187' ' ' LYS . . . -62.2 -42.05 99.72 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.733 -178.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.72 -45.55 93.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.83 0.348 . . . . 0.0 110.555 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -77.24 -29.92 54.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.704 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.405 ' CE2' HG11 ' A' ' 148' ' ' VAL . 45.2 t80 -63.07 -30.64 71.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.635 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 183' ' ' GLY . 72.8 mmtt -67.67 -12.51 60.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.659 178.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 17.0 m -133.87 59.62 1.73 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.067 0.46 . . . . 0.0 111.252 -176.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.802 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 67.8 mt -105.79 119.14 53.43 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.782 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.94 126.86 14.39 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.869 2.379 . . . . 0.0 111.17 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -142.15 131.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.103 0.478 . . . . 0.0 111.537 -175.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -109.36 125.44 52.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.938 177.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.6 tt0 -49.32 -62.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -172.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 194' ' ' LYS . 38.0 ttpt -55.89 -60.25 3.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.54 -42.01 64.02 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.115 0.483 . . . . 0.0 111.376 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 56.9 m -68.72 -41.05 79.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.188 -176.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 60.5 mt -66.11 -48.7 70.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.341 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.1 m -56.34 -46.49 79.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.755 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . 0.575 ' HA ' ' CE2' ' A' ' 202' ' ' TYR . 71.2 m -62.2 -48.85 78.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.246 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.585 ' CD1' HD22 ' B' ' 488' ' ' LEU . 82.6 t80 -60.38 -49.29 78.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.861 0.362 . . . . 0.0 110.633 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.49 HD11 ' HE2' ' B' ' 468' ' ' PHE . 61.9 mt -58.0 -52.17 61.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.769 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . 0.575 ' CE2' ' HA ' ' A' ' 199' ' ' CYS . 2.2 p90 -69.45 -35.3 75.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.915 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 44.8 m -64.93 -50.99 64.29 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.755 0.312 . . . . 0.0 110.629 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.426 HG21 ' CE1' ' A' ' 200' ' ' PHE . 47.0 t -69.58 -25.58 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.929 -176.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 201' ' ' ILE . 33.6 mtp180 . . . . . 0 C--N 1.328 -0.366 0 CA-C-O 120.775 0.321 . . . . 0.0 111.338 175.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.529 0.159 0 CA-C-O 120.692 0.282 . . . . 0.0 110.722 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' B' ' 464' ' ' GLU . 32.0 mp0 -64.95 -48.08 75.36 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 3.6 m -63.19 -35.92 81.9 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.863 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 59.5 tp -60.41 -49.13 78.79 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.413 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.551 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.0 t80 -53.43 -57.68 9.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.42 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.49 ' HE2' HD11 ' A' ' 201' ' ' ILE . 54.5 m-85 -62.52 -33.6 75.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.508 -175.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.83 -44.76 84.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.231 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -67.73 -32.45 73.07 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.22 176.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 467' ' ' PHE . 76.2 t -59.85 -50.65 79.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.002 0.429 . . . . 0.0 109.935 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . 0.435 ' HG3' ' CE1' ' B' ' 481' ' ' TYR . 4.7 mtt-85 -56.28 -49.61 73.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.591 175.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -65.44 -41.38 93.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.049 -175.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -81.64 -40.7 22.52 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -68.39 -39.08 81.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.99 -178.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 43.0 ttm180 71.03 -47.56 0.66 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.72 0.637 . . . . 0.0 111.884 175.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 27.3 t -72.92 130.54 40.62 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.98 0.419 . . . . 0.0 110.535 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.0 69.79 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.814 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -75.04 -34.28 61.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.53 -42.49 74.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 177.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' B' ' 472' ' ' ARG . 60.0 t80 -63.73 -40.49 96.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.066 175.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 30.2 tt0 -65.09 -38.16 89.84 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.87 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 13.9 t-20 -55.35 -47.6 75.51 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.967 174.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 85.8 t80 -53.6 -44.39 69.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.937 176.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.536 ' HB3' HG21 ' A' ' 191' ' ' VAL . 83.1 mt -69.98 -28.96 65.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.383 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.802 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 21.6 mmt85 -63.2 -49.28 74.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.512 0.673 . . . . 0.0 109.335 174.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.6 m -57.8 -35.76 71.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.216 176.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.585 HD22 ' CD1' ' A' ' 200' ' ' PHE . 24.8 mt -65.79 -54.45 26.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.309 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.6 m -58.64 -42.53 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.92 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.528 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 20.8 pt -70.6 -31.32 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.881 -0.728 . . . . 0.0 111.161 179.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.22 -37.54 75.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.588 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.81 -30.44 71.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.265 0.555 . . . . 0.0 110.075 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.56 1.02 50.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.327 175.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 56.52 36.94 28.37 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.185 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.673 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.8 t -78.6 -46.24 24.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.408 174.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.449 ' HA ' HG23 ' A' ' 157' ' ' THR . 39.8 pt -102.9 141.67 18.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.721 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.548 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 8.0 m -81.76 179.21 7.92 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.558 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.577 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.4 ttm180 -60.21 -57.87 10.97 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.823 -0.172 . . . . 0.0 110.629 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.96 70.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.018 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.548 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 19.8 mm-40 -61.14 -49.97 75.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.521 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.488 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 61.5 tp -59.35 -45.74 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.879 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.577 HG23 ' O ' ' B' ' 498' ' ' ARG . 57.6 t -61.06 -40.7 86.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.186 -178.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -82.84 -22.41 34.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 153' ' ' LEU . 11.5 tp -67.31 -49.88 62.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.525 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.55 HG22 ' HB2' ' B' ' 508' ' ' PHE . 9.8 p -86.18 13.05 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.55 -176.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.537 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 22.8 t -57.19 -45.07 99.96 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' B' ' 506' ' ' SER . 11.7 Cg_endo -59.24 -17.95 42.12 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.287 1.991 . . . . 0.0 113.009 174.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.55 ' HB2' HG22 ' B' ' 505' ' ' VAL . 27.4 m-85 -105.71 149.12 26.69 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.422 HD22 HD23 ' B' ' 515' ' ' LEU . 71.9 mt 68.56 -17.73 0.18 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 177.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' B' ' 508' ' ' PHE . . . -65.89 -15.03 61.89 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.501 -0.381 . . . . 0.0 113.295 -176.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.451 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.8 mptp? -85.09 -10.39 56.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.109 0.481 . . . . 0.0 109.779 177.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -123.2 92.96 48.61 Favored Pre-proline 0 C--O 1.235 0.334 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.95 -175.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.05 -53.53 6.99 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.316 2.677 . . . . 0.0 113.564 -174.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -57.91 -37.42 74.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 111.948 -176.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 509' ' ' LEU . 15.6 tp -79.48 -43.35 23.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.575 -171.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.465 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 0.6 OUTLIER -70.88 -28.41 64.53 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.141 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -67.73 -42.99 81.01 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -53.32 -48.58 68.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.488 ' HZ ' ' HG ' ' B' ' 501' ' ' LEU . 43.0 t80 -55.68 -52.41 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.137 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 58.2 mttp -59.76 -40.39 88.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.94 0.4 . . . . 0.0 111.076 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -69.66 -32.78 71.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.534 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.42 ' CZ ' ' HG3' ' A' ' 205' ' ' ARG . 54.5 t80 -82.41 -31.91 29.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.736 0.779 . . . . 0.0 108.972 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.557 HD23 HG22 ' B' ' 502' ' ' VAL . 15.4 tp -81.76 -10.18 59.43 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.904 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.74 39.24 96.43 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.324 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 62.2 t80 . . . . . 0 C--N 1.326 -0.435 0 CA-C-O 120.907 0.384 . . . . 0.0 110.552 -178.495 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.8 m . . . . . 0 N--CA 1.45 -0.475 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.609 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 52.6 Cg_exo -56.55 151.12 47.99 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.761 2.307 . . . . 0.0 112.385 178.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -104.84 142.24 35.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.371 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.97 106.22 19.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.412 0.625 . . . . 0.0 110.316 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -65.56 114.04 4.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.93 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.438 ' HB2' HG13 ' A' ' 179' ' ' VAL . 77.8 mt -100.1 -0.11 39.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.243 0.544 . . . . 0.0 110.369 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -75.3 -20.84 58.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.183 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.443 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 3.0 pt20 -70.29 -25.97 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.457 178.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.44 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -68.29 161.29 27.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.327 0.584 . . . . 0.0 111.29 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.39 158.11 30.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.251 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.416 HG13 ' CD1' ' A' ' 178' ' ' LEU . 51.7 t -59.13 -44.77 92.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.159 0.504 . . . . 0.0 109.658 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 86.5 m-20 -62.09 -35.28 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.082 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 41.4 m -67.36 -45.82 75.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.842 0.353 . . . . 0.0 110.824 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.98 -40.17 90.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.198 0.523 . . . . 0.0 110.802 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 163' ' ' ARG . 94.5 mtt180 -67.03 -37.24 83.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.347 175.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.8 ttm180 -61.46 -45.0 96.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.079 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -53.33 -50.28 65.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.091 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HD3' ' CG2' ' A' ' 169' ' ' THR . 47.5 mttp -58.64 -45.49 89.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.144 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 159' ' ' ARG . 30.8 mmm180 -72.56 -39.29 67.56 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.407 -175.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -71.94 -33.72 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 111.344 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.406 ' CE1' HG22 ' B' ' 490' ' ' ILE . 40.4 m-85 -93.29 3.11 56.18 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.421 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt 61.56 48.95 5.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.764 173.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.493 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 85.7 mt -92.55 134.09 28.51 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.134 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.493 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 14.6 Cg_exo -69.39 127.32 14.71 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.032 2.488 . . . . 0.0 111.808 176.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.56 ' HB ' HD11 ' A' ' 173' ' ' LEU . 16.6 p . . . . . 0 C--N 1.321 -0.64 0 CA-C-O 121.056 0.455 . . . . 0.0 111.352 179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.56 HD11 ' HB ' ' A' ' 169' ' ' THR . 85.8 mt . . . . . 0 C--O 1.233 0.226 0 CA-C-O 121.418 0.628 . . . . 0.0 111.634 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.488 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 11.1 t-20 -136.06 159.93 40.2 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.588 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.65 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.3 tptm -48.16 -54.31 13.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.289 0.368 . . . . 0.0 111.425 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -61.1 -37.47 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.113 -178.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.488 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.1 mm100 -63.92 -40.96 97.7 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.377 0.608 . . . . 0.0 110.068 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.476 ' O ' HG23 ' A' ' 182' ' ' VAL . 87.9 mt -61.16 -49.77 75.89 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 177.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 175' ' ' LYS . 19.0 t -56.92 -47.06 83.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 O-C-N 123.777 0.673 . . . . 0.0 111.034 -178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.0 mt-10 -58.7 -50.11 75.1 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.3 mt -61.96 -39.0 82.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.858 0.361 . . . . 0.0 110.761 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.606 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 71.9 t -64.02 -49.56 81.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.707 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.43 -33.71 85.61 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.473 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.03 -49.12 79.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.824 0.345 . . . . 0.0 110.298 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -83.57 -23.53 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.056 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.3 t80 -58.54 -40.67 83.61 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.88 0.472 . . . . 0.0 110.67 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.78 0.23 27.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.87 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -107.25 13.77 26.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.809 0.338 . . . . 0.0 111.027 -179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.717 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 74.7 mt -90.89 116.61 66.79 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.899 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.4 112.09 3.45 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.657 2.238 . . . . 0.0 111.345 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.0 p -120.11 137.2 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -108.23 136.38 47.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.178 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -58.25 -61.87 2.25 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -55.98 -55.81 28.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.624 -176.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.09 -49.24 69.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.9 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 38.9 m -69.32 -44.94 70.68 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.402 HD11 ' OH ' ' B' ' 481' ' ' TYR . 56.4 mt -60.12 -41.52 92.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.92 0.39 . . . . 0.0 110.129 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 54.4 m -58.93 -47.55 84.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.86 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.87 -45.97 92.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.575 ' CD1' HD22 ' B' ' 488' ' ' LEU . 65.6 t80 -61.43 -58.86 6.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.312 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.533 HD11 ' HE2' ' B' ' 468' ' ' PHE . 67.8 mt -56.38 -43.41 77.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.025 0.441 . . . . 0.0 110.707 -175.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -62.52 -46.38 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.179 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 21.3 m -68.71 -39.94 80.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.678 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 200' ' ' PHE . 21.6 t -75.69 -25.78 17.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.867 0.365 . . . . 0.0 111.099 -176.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 205' ' ' ARG . 13.3 mtp180 . . . . . 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 110.553 173.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.1 t . . . . . 0 CA--C 1.531 0.219 0 CA-C-O 120.863 0.364 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.412 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 7.2 mp0 -66.68 -52.66 42.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 178.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.0 t -63.01 -34.06 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.885 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 42.2 tp -59.24 -50.85 72.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.829 175.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.525 ' O ' HG23 ' B' ' 471' ' ' VAL . 68.5 t80 -52.91 -52.45 57.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.72 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.533 ' HE2' HD11 ' A' ' 201' ' ' ILE . 35.2 m-85 -62.87 -36.51 83.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -176.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.27 -39.01 86.0 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . 0.505 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 64.0 mttm -59.85 -49.65 76.86 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.397 174.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.601 HG13 HD21 ' B' ' 509' ' ' LEU . 64.2 t -55.95 -48.0 79.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 121.334 0.587 . . . . 0.0 110.302 177.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -59.59 -33.67 71.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.05 -177.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -86.26 -50.18 7.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.415 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -67.76 -32.4 72.96 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.86 -21.04 66.03 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 64.93 0.43 1.2 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -134.82 129.98 35.35 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.915 0.388 . . . . 0.0 110.86 -177.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.03 -39.23 90.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.364 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.12 -31.51 72.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.96 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.609 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.78 -47.19 79.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 75.8 t80 -65.75 -35.9 82.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.832 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.29 -38.03 89.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.442 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' B' ' 486' ' ' ARG . 7.1 t30 -72.78 -30.99 64.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.12 0.486 . . . . 0.0 110.323 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 68.4 t80 -60.48 -50.48 73.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.314 0.578 . . . . 0.0 109.471 171.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 75.5 mt -64.83 -29.1 70.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.457 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.717 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 2.4 tpp85 -60.19 -49.11 78.9 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.861 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 37.9 m -63.04 -31.13 72.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.57 175.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 200' ' ' PHE . 33.6 mt -68.88 -45.19 71.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.585 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.2 m -65.83 -40.73 88.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.264 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.553 HD13 ' HE1' ' A' ' 186' ' ' PHE . 39.9 pt -67.84 -32.44 56.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 119.689 -0.804 . . . . 0.0 110.487 177.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -63.93 -43.03 97.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.251 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -63.5 -29.64 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.186 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 79.3 mt-30 -95.17 17.84 13.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.799 -177.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 59.95 27.15 16.48 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.407 0.683 . . . . 0.0 112.056 177.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.522 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 88.0 t -78.21 -41.56 26.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.303 0.573 . . . . 0.0 109.606 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 48.1 pt -124.68 154.17 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.819 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.3 t -102.94 -169.4 1.65 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.515 ' O ' HG23 ' B' ' 502' ' ' VAL . 19.5 ttm180 -55.54 -55.48 31.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.442 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -54.01 -50.45 66.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.486 -176.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.545 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 2.4 mp0 -59.91 -46.31 89.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.118 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.422 HD23 HD21 ' B' ' 523' ' ' LEU . 65.2 tp -57.83 -44.7 86.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.918 0.39 . . . . 0.0 111.114 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.64 HG22 HD23 ' B' ' 523' ' ' LEU . 59.7 t -67.79 -36.39 75.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.443 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 26.5 mt-30 -77.27 -35.11 55.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.266 -177.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 91.1 mt -65.7 -37.71 87.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 0.0 111.503 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.7 p -87.11 6.7 2.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.967 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.6 t -59.01 -49.2 94.62 Favored Pre-proline 0 CA--C 1.542 0.638 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.741 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 36.8 Cg_exo -63.06 -6.38 9.51 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.228 1.952 . . . . 0.0 113.132 177.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.479 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 68.3 m-85 -108.4 -66.02 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.665 -178.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.601 HD21 HG13 ' B' ' 471' ' ' VAL . 82.4 mt -90.99 -13.15 33.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.72 -12.06 66.81 Favored Glycine 0 C--O 1.23 -0.109 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.077 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -80.15 -13.66 59.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.352 0.596 . . . . 0.0 109.8 176.866 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.76 89.47 47.84 Favored Pre-proline 0 N--CA 1.451 -0.416 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.809 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' B' ' 517' ' ' ASN . 74.4 Cg_exo -51.88 -35.94 61.68 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.319 2.679 . . . . 0.0 113.313 -177.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.18 -48.64 50.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.275 0.559 . . . . 0.0 110.408 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.524 HD23 HD22 ' B' ' 509' ' ' LEU . 18.0 tp -67.07 -38.8 86.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.475 0.655 . . . . 0.0 110.044 -178.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -67.29 -32.33 73.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.031 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' B' ' 513' ' ' PRO . 0.2 OUTLIER -64.75 -40.46 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.821 176.721 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.412 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 9.7 t90 -58.65 -49.22 78.31 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.553 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 18.2 t80 -56.95 -46.08 82.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.909 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.66 -37.05 85.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.172 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -65.34 -38.91 91.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.438 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -82.42 -35.02 28.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.562 0.696 . . . . 0.0 109.745 -175.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.64 HD23 HG22 ' B' ' 502' ' ' VAL . 11.8 tp -85.31 -24.9 27.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.367 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 88.87 26.99 25.22 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.638 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 53.8 t80 . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 120.844 0.354 . . . . 0.0 110.272 -179.636 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.2 m . . . . . 0 C--O 1.234 0.278 0 CA-C-O 120.757 0.313 . . . . 0.0 110.576 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 7.4 Cg_exo -70.81 147.23 55.65 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.305 2.003 . . . . 0.0 111.064 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -107.92 152.44 24.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.892 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 5.5 p -99.6 121.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.148 0.499 . . . . 0.0 110.348 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -77.57 121.09 23.43 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 504' ' ' LEU . 85.3 mt -109.38 8.27 25.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.153 0.501 . . . . 0.0 110.616 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -90.8 -25.94 19.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.446 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.472 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 25.6 pt20 -63.71 -26.42 68.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.458 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' B' ' 500' ' ' GLU . 63.7 mt -66.31 161.8 21.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.404 -177.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -79.15 154.63 29.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.606 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.566 HG13 ' CD1' ' A' ' 178' ' ' LEU . 37.0 t -61.31 -39.25 82.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.808 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 5.6 p30 -64.66 -30.01 71.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.541 0.21 . . . . 0.0 110.479 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 17.2 m -68.9 -45.96 69.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.127 0.489 . . . . 0.0 110.395 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.4 mt -65.28 -41.3 94.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.713 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 163' ' ' ARG . 82.8 mtp180 -66.35 -33.36 75.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.455 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 18.3 ttm180 -65.41 -44.71 86.57 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.548 ' HA ' HG13 ' B' ' 495' ' ' VAL . 68.0 t80 -55.74 -50.16 71.13 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.552 174.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.457 ' NZ ' HG21 ' A' ' 181' ' ' ILE . 21.3 mtpp -64.66 -38.71 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.442 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 81.8 mtp180 -76.9 -34.77 57.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.764 0.316 . . . . 0.0 110.738 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -69.85 -47.68 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -85.06 -1.89 57.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.443 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm 58.49 81.36 0.16 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.722 0.639 . . . . 0.0 111.129 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.43 HD12 ' HG2' ' A' ' 162' ' ' LYS . 82.4 mt -116.19 100.53 53.56 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.626 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.47 141.72 89.86 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.263 2.642 . . . . 0.0 111.978 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.417 ' CG2' HD11 ' A' ' 173' ' ' LEU . 4.1 t . . . . . 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.712 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.417 HD11 ' CG2' ' A' ' 169' ' ' THR . 83.5 mt . . . . . 0 CA--C 1.517 -0.293 0 CA-C-O 121.233 0.54 . . . . 0.0 111.29 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.09 -175.56 3.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.726 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.669 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.6 tptm -58.87 -58.37 8.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.233 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.28 69.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 0.0 111.359 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -59.96 -50.45 73.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.306 0.574 . . . . 0.0 110.739 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.566 ' CD1' HG13 ' A' ' 155' ' ' VAL . 68.1 mt -60.51 -43.65 96.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.9 t -57.85 -45.76 87.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.972 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.62 -46.6 89.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.08 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.457 HG21 ' NZ ' ' A' ' 162' ' ' LYS . 63.1 mt -65.4 -45.72 92.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.3 t -60.74 -49.54 84.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.787 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.13 -38.56 95.8 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.169 -0.538 . . . . 0.0 112.235 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.21 -51.55 69.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.575 0.226 . . . . 0.0 110.772 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -80.83 -24.5 38.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.744 0.307 . . . . 0.0 111.183 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.444 ' CE1' HD13 ' B' ' 490' ' ' ILE . 15.5 t80 -61.48 -44.64 96.74 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.452 -178.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -82.37 22.6 0.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 111.416 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -126.99 22.58 6.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.169 0.509 . . . . 0.0 110.143 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.714 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.9 mt -97.72 118.83 63.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.183 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 7.1 Cg_exo -72.93 113.48 3.78 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 122.969 2.446 . . . . 0.0 110.807 174.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.7 p -119.49 156.43 21.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.877 0.37 . . . . 0.0 111.18 -172.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . 0.501 ' O ' ' HB ' ' A' ' 196' ' ' THR . 92.3 m-20 -107.71 147.84 30.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.093 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.7 tt0 -72.28 -66.4 0.65 Allowed 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.597 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -73.43 -45.25 55.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.495 -172.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.76 -42.74 99.82 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.158 -176.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 192' ' ' ASN . 99.4 m -72.68 -38.03 67.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.359 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 37.6 mt -57.69 -51.01 71.28 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 19.5 m -58.49 -44.73 89.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.623 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.2 t -55.06 -54.72 39.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.361 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.593 ' CD1' HD22 ' B' ' 488' ' ' LEU . 70.0 t80 -57.79 -48.65 79.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.616 -177.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 197' ' ' LEU . 91.7 mt -54.89 -51.7 50.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.944 -178.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -67.42 -30.73 70.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.741 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.8 m -63.64 -52.03 62.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 0.0 110.931 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.7 t -68.63 -27.67 37.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.166 0.508 . . . . 0.0 110.264 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.4 ' HD3' HG22 ' A' ' 201' ' ' ILE . 68.8 mtp180 . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.362 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 C--O 1.238 0.453 0 CA-C-O 121.193 0.52 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' B' ' 464' ' ' GLU . 1.9 mp0 -58.81 -36.83 75.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.906 174.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.3 t -60.01 -39.49 85.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.839 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.415 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 59.9 tp -60.56 -49.07 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.065 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -53.73 -54.92 31.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.777 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.478 ' HE2' HD11 ' A' ' 201' ' ' ILE . 38.6 m-85 -65.32 -33.56 76.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.73 -175.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.53 -42.76 98.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.982 0.42 . . . . 0.0 110.133 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 65.8 mttm -58.42 -51.29 70.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.27 174.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . 93.8 t -57.07 -44.35 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.95 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -58.03 -37.44 74.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.382 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -86.86 -38.42 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.979 0.419 . . . . 0.0 111.351 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -65.88 -49.19 68.98 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 -174.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.75 -31.14 72.22 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.216 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 34.9 ttm180 69.32 -59.47 0.48 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.951 0.782 . . . . 0.0 111.986 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -64.42 130.8 45.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.43 78.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.326 176.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -69.63 -39.27 77.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.62 -44.39 82.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.156 177.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 485' ' ' LEU . 84.5 t80 -64.91 -41.14 95.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.931 0.396 . . . . 0.0 110.045 177.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.2 tt0 -60.07 -43.42 95.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.547 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.6 -45.26 89.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.811 178.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.491 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 63.3 t80 -54.33 -48.78 70.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.359 174.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.422 HD11 ' CE2' ' B' ' 481' ' ' TYR . 82.9 mt -63.88 -34.7 78.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.943 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.714 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 18.9 mtt85 -66.23 -36.98 84.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.744 0.307 . . . . 0.0 110.339 176.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.37 -34.27 75.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.488 . . . . 0.0 109.752 174.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.593 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.7 mt -68.23 -45.14 74.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.453 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' B' ' 486' ' ' ARG . 14.9 m -67.14 -42.5 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.694 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.444 HD13 ' CE1' ' A' ' 186' ' ' PHE . 28.0 pt -68.54 -31.18 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.515 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.2 -43.91 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.146 173.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.3 -37.33 85.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.199 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.8 16.0 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.772 -176.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 67.35 10.95 8.11 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 122.608 0.363 . . . . 0.0 111.665 177.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 161' ' ' TYR . 77.2 t -70.91 -42.46 77.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 111.61 -174.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 45.3 pt -117.56 151.25 19.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.732 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.709 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 13.5 m -75.49 160.03 30.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' B' ' 501' ' ' LEU . 16.5 ttp180 -67.48 -36.54 81.32 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.802 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -64.54 -43.95 92.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.349 . . . . 0.0 110.333 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.717 ' HB3' HD22 ' A' ' 153' ' ' LEU . 9.3 mm-40 -55.86 -38.8 70.6 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.656 176.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.433 ' HB3' ' O ' ' B' ' 498' ' ' ARG . 60.2 tp -61.58 -49.78 75.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.471 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.604 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.4 OUTLIER -59.21 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.176 0.512 . . . . 0.0 109.791 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . 0.472 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 44.9 mt-30 -66.51 -42.0 87.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.806 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.551 HD21 HD11 ' A' ' 153' ' ' LEU . 50.2 mt -61.02 -41.97 97.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.878 0.37 . . . . 0.0 111.544 -178.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -87.09 4.06 4.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.016 -178.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.513 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 33.7 t -58.83 -48.39 96.91 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.944 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 52.7 Cg_exo -56.73 -20.66 36.04 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.808 1.672 . . . . 0.0 112.734 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.434 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 72.8 m-85 -96.66 -60.59 1.57 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.182 -175.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.711 ' HG ' HG22 ' B' ' 505' ' ' VAL . 55.6 mt -84.61 -19.84 32.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.077 -175.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.16 -8.92 52.66 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.316 -0.468 . . . . 0.0 112.344 -179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 55.6 mttm -73.31 -21.58 60.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 174.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.643 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 31.8 m-85 -128.0 101.96 22.31 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.86 -49.55 16.57 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.124 2.549 . . . . 0.0 112.704 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -56.9 -43.9 81.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 0.0 111.336 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.58 -44.58 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.998 -174.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 7.9 t80 -70.34 -29.94 66.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.429 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -67.27 -42.26 84.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.842 176.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -54.96 -48.52 73.1 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.484 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.529 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 29.5 t80 -56.45 -51.38 68.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.967 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.457 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 99.2 mttt -59.53 -34.98 73.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.855 0.359 . . . . 0.0 110.917 178.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -66.69 -35.33 79.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.013 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -78.91 -34.09 44.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.22 0.533 . . . . 0.0 110.367 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.451 ' CD2' HG22 ' B' ' 502' ' ' VAL . 11.0 mp -80.7 -16.26 54.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.401 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 69.85 37.11 75.0 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.287 -175.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 14.1 t80 . . . . . 0 C--N 1.322 -0.592 0 CA-C-O 121.111 0.481 . . . . 0.0 110.446 -176.361 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 N--CA 1.451 -0.408 0 CA-C-O 121.176 0.512 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.639 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 31.6 Cg_exo -58.86 152.63 56.19 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.707 2.271 . . . . 0.0 111.756 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -123.53 135.65 54.13 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 -174.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . 0.524 HG11 HD21 ' B' ' 483' ' ' ASN . 4.1 p -96.23 124.77 49.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.315 -177.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 50.9 m-20 -86.39 110.82 19.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.25 176.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . 0.436 HD13 HG12 ' A' ' 182' ' ' VAL . 65.8 mt -90.68 -3.84 57.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.423 0.63 . . . . 0.0 109.885 177.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -77.1 -11.16 59.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.36 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 29.7 pt20 -90.63 -9.38 47.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.291 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.8 mt -77.08 166.06 23.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.2 0.524 . . . . 0.0 111.649 -175.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . 0.437 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 17.2 mt-30 -71.97 154.84 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.343 176.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.94 -42.56 93.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.615 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.34 -31.55 71.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.364 -179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.437 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 10.0 m -66.12 -42.39 89.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.264 0.554 . . . . 0.0 110.469 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 75.7 mt -65.49 -41.62 93.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.249 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.66 -39.21 93.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.248 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.425 ' HG3' ' HA ' ' B' ' 495' ' ' VAL . 27.2 tpt180 -56.88 -52.89 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.477 177.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -52.34 -52.28 54.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.06 176.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.58 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 58.6 mtpt -65.37 -31.5 72.64 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.598 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.71 -47.85 20.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.605 0.24 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . 0.431 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 16.0 t-80 -70.09 -35.98 74.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.791 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.452 ' CE1' HG22 ' B' ' 490' ' ' ILE . 59.0 m-85 -88.86 6.38 39.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.626 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt 56.76 51.42 10.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.73 175.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 90.7 mt -91.76 131.49 35.56 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.575 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 36.0 Cg_exo -59.84 150.16 79.25 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.936 2.424 . . . . 0.0 111.855 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.4 p . . . . . 0 C--N 1.322 -0.611 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.644 -177.746 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 61.9 mt . . . . . 0 CA--C 1.516 -0.349 0 CA-C-O 121.409 0.623 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.528 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 17.1 t-20 -137.48 166.6 23.47 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.076 -0.965 . . . . 0.0 108.671 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.612 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.8 tptm -50.3 -53.12 30.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.358 0.411 . . . . 0.0 110.699 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.79 -40.61 88.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.445 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 24.6 mm-40 -60.05 -46.2 90.31 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.487 0.66 . . . . 0.0 110.257 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 77.2 mt -60.73 -51.13 70.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.171 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 175' ' ' LYS . 46.3 t -57.28 -43.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.275 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 47.6 mt-10 -58.74 -55.57 33.4 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.283 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . 0.58 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 63.8 mt -63.22 -42.24 95.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.607 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 47.2 t -58.66 -49.73 81.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.231 177.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -64.57 -37.24 94.15 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.131 -0.556 . . . . 0.0 112.247 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.1 t -56.67 -48.1 78.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.741 0.305 . . . . 0.0 110.651 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -83.58 -24.73 31.4 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.752 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 54.4 t80 -60.9 -34.28 74.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 64.4 mttm -81.69 -1.03 45.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.896 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.4 t -130.96 45.63 2.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 110.285 -175.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.716 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 64.2 mt -103.16 115.1 64.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.677 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.36 110.1 1.51 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.349 2.033 . . . . 0.0 111.131 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.449 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.6 p -134.18 128.66 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.067 0.461 . . . . 0.0 111.165 -174.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -104.42 126.45 51.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.097 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 38.5 tt0 -49.69 -65.21 0.6 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -172.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -58.44 -50.04 75.14 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -60.45 -41.6 94.42 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.934 -179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 66.8 m -66.78 -41.6 87.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 27.5 mt -58.31 -49.22 77.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -57.2 -47.24 81.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.04 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 78.2 m -58.46 -54.85 42.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.074 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.495 ' CG ' HD22 ' B' ' 488' ' ' LEU . 92.6 t80 -60.94 -47.09 88.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.225 -176.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.439 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 73.0 mt -57.58 -53.49 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.185 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -70.82 -22.66 62.31 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.287 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 72.3 m -67.57 -50.81 56.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.652 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 37.4 t -73.73 -25.06 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 111.068 -177.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 12.2 mmm180 . . . . . 0 N--CA 1.464 0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.138 177.13 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.3 p . . . . . 0 N--CA 1.453 -0.315 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.12 -52.01 67.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.963 0.411 . . . . 0.0 109.958 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.1 m -62.26 -34.54 76.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.444 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.01 -48.81 78.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.349 177.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.554 ' O ' HG23 ' B' ' 471' ' ' VAL . 61.3 t80 -52.5 -55.72 20.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.834 176.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.534 ' CD1' HD22 ' A' ' 197' ' ' LEU . 79.2 m-85 -65.04 -32.78 74.67 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -174.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -63.19 -41.81 99.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.127 0.489 . . . . 0.0 109.897 174.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -68.36 -33.66 74.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.85 176.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 467' ' ' PHE . 97.2 t -61.47 -49.22 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 177.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -62.77 -35.15 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.151 0.5 . . . . 0.0 109.869 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -76.27 -23.85 54.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.467 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -88.42 -54.98 3.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.355 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.61 -44.35 96.53 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 68.46 -56.95 0.5 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.011 0.819 . . . . 0.0 112.588 173.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . 0.452 ' HB3' ' HB3' ' B' ' 480' ' ' ALA . 21.8 t -59.11 137.96 57.75 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.798 0.439 . . . . 0.0 110.802 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -60.32 -55.92 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.309 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.93 -32.82 72.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.639 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -68.77 -50.97 46.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.473 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.27 -37.43 85.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.992 0.425 . . . . 0.0 110.328 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.711 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 26.4 tt0 -67.21 -34.54 77.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.77 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . 0.524 HD21 HG11 ' A' ' 148' ' ' VAL . 20.7 t-20 -59.94 -43.4 94.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.434 175.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.1 -45.33 79.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.08 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.3 mt -66.51 -29.52 69.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.116 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.716 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 17.6 mmt85 -60.46 -46.25 90.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 174.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.7 m -61.97 -34.94 77.06 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.667 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.495 HD22 ' CG ' ' A' ' 200' ' ' PHE . 38.8 mt -66.61 -49.37 66.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.525 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 9.7 m -64.71 -42.01 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.672 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.452 HG22 ' CE1' ' A' ' 165' ' ' PHE . 12.1 pt -69.91 -31.11 46.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.128 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . 0.499 ' HB2' HD12 ' B' ' 501' ' ' LEU . 91.2 t80 -65.44 -44.0 88.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.167 0.508 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.19 -35.52 79.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.653 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . 0.431 ' HB3' ' CE1' ' A' ' 164' ' ' HIS . 77.7 mt-30 -83.62 14.6 3.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.644 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 62.22 28.91 17.3 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.643 0.259 . . . . 0.0 111.149 176.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.425 ' HA ' ' HG3' ' A' ' 160' ' ' ARG . 69.1 t -87.46 -50.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.067 -178.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 46.4 pt -111.26 148.08 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 54.3 p -91.7 -178.66 5.12 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.446 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.711 ' HD3' ' HB2' ' B' ' 525' ' ' TYR . 26.6 ttm180 -55.99 -52.3 64.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.55 -48.35 81.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.352 -177.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.487 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.7 mm-40 -57.21 -46.77 82.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.605 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' B' ' 491' ' ' PHE . 9.6 tt -61.76 -49.29 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.051 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 498' ' ' ARG . 94.7 t -63.15 -30.68 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.878 0.371 . . . . 0.0 111.008 -176.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.11 -36.65 55.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.696 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 67.4 mt -65.63 -41.19 92.94 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.876 0.37 . . . . 0.0 111.506 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 7.3 p -84.25 8.84 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.17 0.51 . . . . 0.0 111.206 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.651 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.6 t -57.46 -53.05 69.6 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.054 -179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.651 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 17.1 Cg_exo -69.09 0.2 5.48 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 122.409 2.073 . . . . 0.0 112.93 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.459 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 81.6 m-85 -109.56 -69.35 0.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.822 0.344 . . . . 0.0 110.565 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 516' ' ' PHE . 70.0 mt -86.75 -16.85 35.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.626 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.22 -15.29 65.26 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.277 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -84.18 -11.91 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.182 0.515 . . . . 0.0 110.2 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -123.03 93.71 48.0 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.692 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.51 -54.14 5.95 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.641 2.894 . . . . 0.0 113.555 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.74 -34.91 70.02 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.497 HD12 ' HA ' ' B' ' 515' ' ' LEU . 4.4 tp -80.56 -39.95 26.78 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.001 0.429 . . . . 0.0 110.257 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 2.9 t80 -67.61 -38.65 84.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.852 178.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -65.69 -42.66 90.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.68 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -57.5 -48.05 80.27 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.45 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.2 OUTLIER -58.91 -46.58 87.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.348 -178.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.96 -44.74 96.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.393 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -64.31 -40.53 96.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.712 -177.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -69.9 -41.97 73.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.507 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.467 HD21 ' CZ ' ' A' ' 200' ' ' PHE . 78.2 mt -77.93 -6.89 55.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.104 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 72.27 32.17 62.92 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.043 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . 0.711 ' HB2' ' HD3' ' B' ' 498' ' ' ARG . 64.4 t80 . . . . . 0 C--N 1.321 -0.643 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 16.0 m . . . . . 0 CA--C 1.533 0.303 0 CA-C-O 120.472 0.177 . . . . 0.0 111.09 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 24.5 Cg_exo -63.85 152.15 81.99 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.433 2.089 . . . . 0.0 111.112 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -131.38 150.56 52.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.894 0.378 . . . . 0.0 111.399 -175.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.71 144.5 9.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.383 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.78 -47.96 17.72 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 112.104 -173.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt 71.57 -38.64 0.43 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.19 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -65.31 -26.15 67.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.571 0.7 . . . . 0.0 109.195 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -55.93 -24.27 36.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.312 174.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.601 HD11 HD21 ' B' ' 504' ' ' LEU . 75.4 mt -75.47 154.61 36.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.237 0.541 . . . . 0.0 111.275 -176.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.66 142.58 58.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.695 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . 0.59 ' HB ' ' HD3' ' A' ' 175' ' ' LYS . 5.1 p -58.4 -31.67 43.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.875 0.369 . . . . 0.0 110.577 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.32 -38.98 88.95 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.542 175.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.629 HG21 ' HG2' ' B' ' 500' ' ' GLU . 39.0 m -67.92 -40.07 83.44 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 75.0 mt -63.85 -44.47 93.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.332 0.587 . . . . 0.0 110.006 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -62.59 -33.66 75.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.169 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.643 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 28.4 ttm180 -67.11 -43.67 81.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.078 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . 0.519 ' HA ' HG13 ' B' ' 495' ' ' VAL . 69.7 t80 -54.88 -56.31 20.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.838 174.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -67.23 -31.84 72.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.433 -174.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -73.06 -43.42 61.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.705 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -66.91 -41.67 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.546 -178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.98 -4.36 52.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.135 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 56.84 56.65 5.26 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.22 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 88.9 mt -88.57 124.04 66.74 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.339 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.85 127.71 24.36 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.749 2.3 . . . . 0.0 111.548 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.57 ' HB ' HD11 ' A' ' 173' ' ' LEU . 1.3 p . . . . . 0 C--N 1.327 -0.386 0 CA-C-O 121.089 0.471 . . . . 0.0 112.135 -175.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . 0.57 HD11 ' HB ' ' A' ' 169' ' ' THR . 99.1 mt . . . . . 0 C--O 1.232 0.161 0 CA-C-O 121.223 0.535 . . . . 0.0 111.855 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.549 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 19.7 t-20 -108.15 159.36 16.66 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.725 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.59 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.8 tptm -49.17 -49.27 43.34 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 122.765 0.426 . . . . 0.0 111.143 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.8 -39.92 91.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.101 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -60.27 -39.58 87.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.125 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.556 ' CD1' HG23 ' A' ' 155' ' ' VAL . 86.3 mt -59.21 -54.68 44.18 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.051 176.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.5 t -56.93 -40.82 74.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 123.833 0.708 . . . . 0.0 111.296 -176.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.7 -50.92 71.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.722 0.296 . . . . 0.0 110.874 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -65.59 -42.88 93.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.588 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 78.9 t -58.38 -49.29 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.35 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.02 94.11 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.575 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -59.42 -45.65 90.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.932 0.396 . . . . 0.0 110.684 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 -83.69 -22.92 31.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.451 . . . . 0.0 110.618 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.588 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.0 t80 -65.47 -41.79 92.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.747 -178.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -71.63 -11.36 60.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.411 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 4.9 p -116.46 22.91 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.916 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 78.2 mt -75.59 125.4 88.63 Favored Pre-proline 0 C--O 1.236 0.359 0 CA-C-O 120.58 0.229 . . . . 0.0 110.456 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 12.6 Cg_exo -70.18 126.41 13.0 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.992 2.461 . . . . 0.0 110.963 174.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 3.8 p -147.21 155.26 11.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.94 -175.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -136.09 133.03 36.88 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.271 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.63 -64.67 0.74 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -55.91 -53.61 54.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.434 -171.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.99 -43.94 97.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.743 0.306 . . . . 0.0 111.822 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 33.3 m -68.61 -43.14 77.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.237 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.13 -49.91 76.08 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 24.9 m -57.85 -46.69 84.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.864 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.38 -49.64 76.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.772 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.535 ' CD1' HD22 ' B' ' 488' ' ' LEU . 61.2 t80 -61.93 -54.77 37.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.215 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.402 ' HA ' ' HZ ' ' B' ' 522' ' ' PHE . 73.6 mt -58.08 -46.05 88.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.198 0.523 . . . . 0.0 110.872 -177.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.58 -40.27 96.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.152 -176.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 16.5 m -70.67 -54.61 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.124 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 43.8 t -61.47 -35.59 67.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 . . . . . 0 C--N 1.331 -0.238 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 178.758 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.5 t . . . . . 0 CA--C 1.53 0.205 0 CA-C-O 120.48 0.181 . . . . 0.0 110.834 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -60.4 3.56 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.79 175.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 39.1 m -65.28 -26.67 68.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.88 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.71 -52.74 59.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.049 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.507 ' O ' HG23 ' B' ' 471' ' ' VAL . 63.7 t80 -54.88 -58.81 6.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.614 176.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -65.01 -27.63 68.96 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -172.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -71.36 -42.13 68.86 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.957 0.408 . . . . 0.0 109.992 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -61.51 -45.49 93.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.191 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.528 HG13 HD21 ' B' ' 509' ' ' LEU . 84.8 t -55.95 -47.66 79.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.797 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -59.41 -40.58 87.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.433 -178.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -79.41 -35.02 41.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.728 0.299 . . . . 0.0 111.198 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -70.91 -46.72 62.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 50.7 mt -61.04 -43.55 98.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.494 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' B' ' 476' ' ' ARG . 25.6 ttt180 70.68 -61.2 0.48 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.154 0.909 . . . . 0.0 112.326 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.8 t -62.87 145.19 55.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.719 -176.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.44 -50.84 63.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.627 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.61 -24.4 64.57 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.359 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.602 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.88 -56.08 15.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.053 0.454 . . . . 0.0 110.186 177.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.409 ' CE2' HD11 ' B' ' 485' ' ' LEU . 62.4 t80 -66.74 -37.16 84.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.255 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 34.2 tt0 -63.99 -45.87 87.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.438 179.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -60.39 -39.84 88.75 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 67.5 t80 -55.57 -49.91 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.135 174.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.409 HD11 ' CE2' ' B' ' 481' ' ' TYR . 88.6 mt -65.06 -33.97 77.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.188 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.916 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 26.1 mtt180 -64.85 -41.3 95.81 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.893 0.377 . . . . 0.0 110.277 177.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 61.4 m -60.87 -34.73 75.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.979 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.535 HD22 ' CD1' ' A' ' 200' ' ' PHE . 44.3 mt -66.99 -52.41 42.98 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.086 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' B' ' 486' ' ' ARG . 10.8 m -59.6 -42.24 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -177.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.577 ' HA ' ' HG2' ' B' ' 493' ' ' GLN . 17.1 pt -70.47 -32.31 49.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.146 -0.622 . . . . 0.0 111.132 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -64.97 -45.7 84.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.196 0.522 . . . . 0.0 110.176 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -63.94 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.029 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . 0.851 ' HG3' HG23 ' B' ' 495' ' ' VAL . 10.7 pt20 -93.68 13.3 22.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.303 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 67.6 35.59 4.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.308 173.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.851 HG23 ' HG3' ' B' ' 493' ' ' GLN . 64.8 t -88.8 -52.91 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.029 0.443 . . . . 0.0 110.061 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.422 HG12 HG13 ' B' ' 490' ' ' ILE . 49.5 pt -110.08 145.02 17.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.125 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . 0.443 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.2 t -84.93 178.49 7.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.981 0.419 . . . . 0.0 110.385 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.59 ' O ' HG23 ' B' ' 502' ' ' VAL . 9.5 ttp180 -55.38 -47.7 75.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.251 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.09 -53.11 62.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.162 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . 0.629 ' HG2' HG21 ' A' ' 157' ' ' THR . 1.9 mp0 -56.6 -40.31 75.09 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.795 HD23 HD21 ' B' ' 523' ' ' LEU . 67.8 tp -60.03 -49.39 77.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 110.939 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 498' ' ' ARG . 8.1 t -68.06 -30.32 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.41 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.47 -46.08 70.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.344 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.601 HD21 HD11 ' A' ' 153' ' ' LEU . 86.4 mt -62.37 -40.31 96.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.988 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -87.23 6.78 2.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.084 0.468 . . . . 0.0 111.194 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.654 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 40.3 t -56.19 -52.98 68.59 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.733 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.3 Cg_exo -66.58 -7.94 19.5 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.055 1.837 . . . . 0.0 113.056 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.473 ' O ' ' HD3' ' B' ' 511' ' ' LYS . 96.5 m-85 -100.15 -50.18 4.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.516 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.528 HD21 HG13 ' B' ' 471' ' ' VAL . 86.9 mt -106.6 -8.45 16.96 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.392 -177.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.44 -20.17 69.42 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.269 -176.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' B' ' 508' ' ' PHE . 0.0 OUTLIER -83.05 -5.11 58.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.745 0.307 . . . . 0.0 110.652 177.797 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.433 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 58.7 m-85 -118.71 93.23 45.79 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 9.4 Cg_endo -51.8 -54.23 5.66 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.483 2.788 . . . . 0.0 113.673 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -65.1 -44.57 88.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.303 0.573 . . . . 0.0 110.429 -176.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.64 -42.72 98.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.797 -176.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -72.09 -31.98 66.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.691 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -70.26 -34.69 73.12 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.506 177.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -60.25 -49.22 78.47 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.664 ' O ' HD12 ' B' ' 523' ' ' LEU . 33.1 t80 -54.98 -53.53 54.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.506 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -56.17 -40.94 74.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.784 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -63.46 -35.94 82.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.978 0.418 . . . . 0.0 110.459 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . 0.402 ' HZ ' ' HA ' ' A' ' 201' ' ' ILE . 60.7 t80 -65.07 -41.4 95.13 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.653 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.795 HD21 HD23 ' B' ' 501' ' ' LEU . 3.6 mp -76.98 -15.35 59.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.205 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.62 34.06 63.27 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -171.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 69.2 t80 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 115.013 -0.593 . . . . 0.0 110.494 -174.226 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.454 -0.243 0 N-CA-C 110.42 -0.215 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 19.3 Cg_exo -63.47 148.1 92.81 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.069 1.846 . . . . 0.0 110.888 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -106.32 158.42 16.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.828 0.347 . . . . 0.0 111.038 -173.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.4 p -110.22 131.79 60.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.412 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -87.92 124.88 34.14 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 88.6 mt -110.17 5.97 22.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -94.01 -15.93 24.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -73.48 -19.5 60.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.397 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' LEU . . . . . 0.46 HD11 HD21 ' B' ' 504' ' ' LEU . 72.5 mt -71.41 156.52 39.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 111.39 -177.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -69.98 158.75 35.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.365 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.51 -41.4 92.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.81 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -64.98 -39.78 93.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.507 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' THR . . . . . 0.432 ' CG2' HG22 ' B' ' 496' ' ' ILE . 25.0 m -57.36 -47.91 80.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.096 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.35 -41.86 96.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.684 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -65.98 -33.52 75.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.623 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' ARG . . . . . 0.472 ' HD3' ' O ' ' B' ' 495' ' ' VAL . 17.9 ttt85 -67.29 -44.4 79.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.212 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -53.47 -49.98 66.3 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.444 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' LYS . . . . . 0.599 ' HE2' HG21 ' A' ' 169' ' ' THR . 9.1 mtpm? -56.9 -42.17 79.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.802 -179.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -72.94 -47.65 43.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.602 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -71.79 -31.58 66.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' PHE . . . . . 0.426 ' CE1' HG22 ' B' ' 490' ' ' ILE . 32.3 m-85 -93.29 1.96 56.78 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.064 178.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 58.2 73.95 0.45 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.448 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.421 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 92.4 mt -114.73 107.66 50.28 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.415 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 37.5 Cg_endo -67.01 126.2 14.82 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.404 2.069 . . . . 0.0 111.419 178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' THR . . . . . 0.599 HG21 ' HE2' ' A' ' 162' ' ' LYS . 15.0 p . . . . . 0 C--N 1.322 -0.617 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.266 -175.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 C--O 1.233 0.194 0 CA-C-O 121.135 0.493 . . . . 0.0 111.386 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 174' ' ' ASN . . . . . 0.631 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 59.4 m-80 -136.18 177.05 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.689 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 175' ' ' LYS . . . . . 0.581 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.9 tptm -53.03 -56.07 18.91 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.405 0.44 . . . . 0.0 111.791 -176.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -59.67 -35.5 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.182 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 177' ' ' GLN . . . . . 0.413 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 14.6 mm-40 -66.63 -46.83 74.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.271 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 178' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 69.7 mt -60.04 -48.02 83.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 179' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 175' ' ' LYS . 49.0 t -58.27 -43.33 85.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.943 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -45.94 91.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.581 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 72.5 mt -66.43 -47.64 83.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 CA-C-O 120.994 0.426 . . . . 0.0 110.616 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 182' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 74.1 t -59.87 -49.58 83.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.499 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.53 -40.49 98.78 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.412 -0.423 . . . . 0.0 112.255 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 44.2 t -54.91 -48.55 72.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.807 0.337 . . . . 0.0 110.947 178.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -83.64 -24.95 31.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -177.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 186' ' ' PHE . . . . . 0.508 ' HE1' HD13 ' B' ' 490' ' ' ILE . 39.1 t80 -64.72 -39.43 93.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 122.87 0.468 . . . . 0.0 110.963 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -74.75 5.53 4.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.682 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.4 p -133.43 24.02 4.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.659 0.266 . . . . 0.0 111.477 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 189' ' ' ILE . . . . . 0.587 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.4 mt -86.73 117.69 69.03 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.612 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.66 122.59 9.78 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.808 2.339 . . . . 0.0 111.168 175.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 191' ' ' VAL . . . . . 0.574 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.4 p -134.5 147.36 29.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.906 0.384 . . . . 0.0 110.97 -175.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -118.04 118.47 32.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.142 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 193' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 86.8 tt0 -48.78 -58.78 4.26 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 0.0 112.633 -173.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 194' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 194' ' ' LYS . 0.5 OUTLIER -64.68 -49.18 71.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.497 0.189 . . . . 0.0 111.166 -173.368 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.0 -46.51 84.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.792 0.329 . . . . 0.0 111.369 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.5 m -63.03 -41.28 99.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.43 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 197' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 59.1 mt -60.42 -46.37 90.24 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 175.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 47.2 m -58.61 -46.68 86.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.732 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 66.1 m -57.05 -54.61 44.84 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.545 177.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 200' ' ' PHE . . . . . 0.517 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.7 t80 -56.56 -53.11 61.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.348 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 201' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 197' ' ' LEU . 74.7 mt -55.85 -52.09 52.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.484 -175.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -70.51 -25.94 63.36 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.2 m -72.17 -46.36 56.67 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.706 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 204' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 200' ' ' PHE . 22.0 t -76.2 -35.33 27.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.204 -175.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 205' ' ' ARG . . . . . 0.568 ' HD2' ' OE2' ' B' ' 464' ' ' GLU . 17.9 mtp180 . . . . . 0 C--N 1.33 -0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.068 178.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 120.715 0.293 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 464' ' ' GLU . . . . . 0.568 ' OE2' ' HD2' ' A' ' 205' ' ' ARG . 1.7 mp0 -54.98 -44.45 74.46 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 175.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.0 t -60.5 -40.35 91.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.023 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 466' ' ' LEU . . . . . 0.535 HD21 ' HE3' ' B' ' 470' ' ' LYS . 8.9 tt -62.14 -49.33 76.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.798 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 467' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.5 t80 -54.16 -58.04 8.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.721 176.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 468' ' ' PHE . . . . . 0.4 ' HE1' ' HZ ' ' B' ' 484' ' ' PHE . 46.1 m-85 -64.54 -29.59 70.62 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -174.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.01 -45.04 78.75 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 470' ' ' LYS . . . . . 0.535 ' HE3' HD21 ' B' ' 466' ' ' LEU . 89.8 mttt -64.31 -40.14 95.32 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.701 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 471' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.1 t -59.79 -42.19 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.499 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.49 -46.36 83.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.921 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -75.67 -34.35 60.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.375 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 474' ' ' ALA . . . . . 0.43 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -69.75 -53.8 16.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.967 -175.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.46 -33.98 76.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.207 -176.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 69.2 -59.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.962 0.789 . . . . 0.0 112.04 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 477' ' ' SER . . . . . 0.401 ' HB3' ' HB3' ' B' ' 480' ' ' ALA . 30.5 t -62.52 126.68 28.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.057 0.456 . . . . 0.0 111.261 -178.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.07 -30.36 70.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.023 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -72.79 -40.71 65.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.924 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 480' ' ' ALA . . . . . 0.486 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.46 -43.41 97.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.468 176.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 481' ' ' TYR . . . . . 0.469 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 47.2 t80 -66.53 -38.53 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.081 178.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 482' ' ' GLU . . . . . 0.515 ' HG3' ' CG1' ' A' ' 191' ' ' VAL . 37.8 tt0 -60.62 -40.48 92.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.204 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.43 -42.52 99.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 484' ' ' PHE . . . . . 0.4 ' HZ ' ' HE1' ' B' ' 468' ' ' PHE . 46.6 t80 -55.74 -42.61 75.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.384 172.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 485' ' ' LEU . . . . . 0.574 ' HB3' HG21 ' A' ' 191' ' ' VAL . 92.1 mt -66.99 -32.97 74.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 486' ' ' ARG . . . . . 0.587 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.2 OUTLIER -59.68 -43.24 94.08 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.113 0.482 . . . . 0.0 110.059 172.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.4 m -60.84 -35.67 77.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.155 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 488' ' ' LEU . . . . . 0.517 HD22 ' CD1' ' A' ' 200' ' ' PHE . 41.9 mt -68.52 -46.17 70.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.586 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.9 m -65.34 -42.06 92.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.555 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 490' ' ' ILE . . . . . 0.508 HD13 ' HE1' ' A' ' 186' ' ' PHE . 11.3 pt -69.98 -29.64 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.926 178.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -68.23 -42.4 79.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.225 0.536 . . . . 0.0 109.789 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -59.24 -41.29 88.41 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.126 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -89.01 18.02 5.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.169 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 54.28 48.19 21.35 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.765 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 495' ' ' VAL . . . . . 0.472 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 83.2 t -98.21 -42.45 11.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.85 175.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 496' ' ' ILE . . . . . 0.432 HG22 ' CG2' ' A' ' 157' ' ' THR . 41.7 pt -115.82 151.23 17.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.695 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 78.2 p -89.84 177.29 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.624 0.249 . . . . 0.0 110.5 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 498' ' ' ARG . . . . . 0.433 ' O ' HG23 ' B' ' 502' ' ' VAL . 22.9 mtm180 -52.38 -54.17 35.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.449 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.66 -48.48 77.5 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.49 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.13 -39.81 75.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.722 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 501' ' ' LEU . . . . . 0.573 HD23 HD21 ' B' ' 523' ' ' LEU . 53.7 tp -62.95 -47.4 83.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 502' ' ' VAL . . . . . 0.502 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.2 OUTLIER -64.62 -31.3 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.266 0.555 . . . . 0.0 109.923 -179.629 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -67.26 -45.86 75.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.604 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 504' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 153' ' ' LEU . 77.9 mt -64.2 -41.53 97.03 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 505' ' ' VAL . . . . . 0.412 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.3 p -85.37 3.8 3.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.931 0.396 . . . . 0.0 111.113 -178.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 506' ' ' SER . . . . . 0.597 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 22.9 t -55.7 -51.54 79.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 507' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 50.4 Cg_exo -57.03 -35.04 98.78 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.877 1.718 . . . . 0.0 112.486 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 508' ' ' PHE . . . . . 0.406 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 83.4 m-85 -73.74 -40.86 63.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.27 -174.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 509' ' ' LEU . . . . . 0.412 ' HG ' HG22 ' B' ' 505' ' ' VAL . 81.2 mt -101.95 4.71 40.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.82 0.343 . . . . 0.0 111.242 -176.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.48 -18.41 69.75 Favored Glycine 0 N--CA 1.455 -0.068 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.766 -177.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 511' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' B' ' 511' ' ' LYS . 2.6 mptp? -93.78 -4.71 49.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.076 0.465 . . . . 0.0 109.79 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 512' ' ' PHE . . . . . 0.43 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 43.7 m-85 -129.56 87.28 53.35 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.644 -172.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.55 -43.45 58.84 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.229 2.619 . . . . 0.0 113.18 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.69 -44.4 96.58 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.133 0.492 . . . . 0.0 110.709 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 515' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 515' ' ' LEU . 1.4 tp -69.28 -46.61 66.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.423 -173.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 516' ' ' PHE . . . . . 0.511 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 44.5 t80 -66.78 -36.38 82.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.907 0.384 . . . . 0.0 110.623 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.69 -41.55 75.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.545 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 518' ' ' TRP . . . . . 0.439 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 29.3 t90 -55.14 -48.21 74.02 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 175.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 519' ' ' PHE . . . . . 0.567 ' O ' HD13 ' B' ' 523' ' ' LEU . 19.0 t80 -56.99 -46.96 81.87 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.622 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 520' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 83.1 mttt -56.33 -50.42 71.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.259 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.14 -32.81 74.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.452 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -69.15 -44.12 72.96 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.369 0.604 . . . . 0.0 109.5 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 523' ' ' LEU . . . . . 0.573 HD21 HD23 ' B' ' 501' ' ' LEU . 9.7 mp -73.95 -19.72 60.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.674 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.23 13.99 69.94 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 71.7 t80 . . . . . 0 C--N 1.327 -0.371 0 CA-C-O 121.186 0.517 . . . . 0.0 110.455 -175.367 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 35.0 p . . . . . 0 N--CA 1.478 0.951 0 CA-C-O 120.425 0.155 . . . . 0.0 110.713 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 67.38 177.44 0.24 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.535 177.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 64.27 17.01 10.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.944 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -120.86 -18.16 3.99 Favored Glycine 0 N--CA 1.45 -0.397 0 C-N-CA 120.707 -0.758 . . . . 0.0 112.037 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 29.5 m -145.26 165.44 28.38 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -103.22 11.85 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.709 0.29 . . . . 0.0 111.451 -179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -70.79 170.78 11.78 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.043 0.449 . . . . 0.0 110.696 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -87.51 137.02 32.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.531 178.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -99.83 18.8 55.42 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.918 -177.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 137' ' ' ASP . . . -107.07 -11.03 26.91 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.331 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.408 ' HB3' ' O ' ' A' ' 136' ' ' GLY . 19.4 t70 72.67 -54.93 0.69 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 123.4 0.68 . . . . 0.0 111.171 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 22.9 t -145.38 119.34 5.5 Favored Pre-proline 0 C--N 1.32 -0.699 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 177.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -66.35 168.59 15.78 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.53 2.153 . . . . 0.0 111.662 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.3 p -70.53 100.48 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-O 121.619 0.723 . . . . 0.0 110.693 179.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -166.64 106.93 0.65 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.78 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -82.36 -5.53 58.67 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.421 0.629 . . . . 0.0 110.131 178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 19.4 mt -93.42 145.52 7.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.406 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.489 ' O ' ' HB ' ' A' ' 145' ' ' THR . 3.4 m-20 -82.77 15.44 2.66 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 120.854 0.359 . . . . 0.0 110.895 178.718 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 144' ' ' ASP . 53.5 m 72.02 112.0 0.03 OUTLIER Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.324 -174.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_exo -59.02 132.79 49.36 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.546 2.164 . . . . 0.0 111.737 -178.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -102.72 138.23 39.9 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.239 -179.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.2 p -86.68 125.3 40.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 CA-C-O 121.297 0.57 . . . . 0.0 111.277 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.445 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 19.5 t0 -81.81 114.38 20.4 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.589 174.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.73 HD23 HD11 ' B' ' 504' ' ' LEU . 56.3 mt -100.01 -0.45 39.22 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.335 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.9 t80 -82.66 -19.36 38.33 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.827 -0.624 . . . . 0.0 109.503 -179.267 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.503 ' NE2' ' HA ' ' B' ' 504' ' ' LEU . 28.8 pt20 -71.01 -26.8 63.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.847 178.309 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.552 HD21 HD13 ' B' ' 504' ' ' LEU . 86.5 mt -65.25 149.21 50.33 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.687 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -65.73 152.53 44.06 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.223 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.472 HG22 ' HD3' ' A' ' 175' ' ' LYS . 57.6 t -55.93 -40.1 60.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.309 0.576 . . . . 0.0 109.796 176.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -63.84 -39.04 93.28 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.065 -0.971 . . . . 0.0 110.527 -179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.404 HG23 ' HA ' ' B' ' 496' ' ' ILE . 23.0 m -64.21 -44.77 90.9 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.14 179.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 94.5 mt -66.07 -41.7 90.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.15 0.5 . . . . 0.0 110.961 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 71.2 mtp180 -66.63 -32.39 73.69 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.418 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.593 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.2 ttm180 -67.47 -44.46 78.51 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.013 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -51.5 -49.58 61.59 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.063 0.458 . . . . 0.0 110.224 172.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.419 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.4 mtpm? -63.52 -32.92 74.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.884 -178.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 35.5 ttm180 -79.89 -39.14 31.08 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.636 0.255 . . . . 0.0 111.328 -178.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -77.87 -32.82 52.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 120.864 -0.334 . . . . 0.0 110.96 -176.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 41.4 m-85 -91.06 -4.95 55.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.547 -0.297 . . . . 0.0 110.971 177.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 8.8 mptt 56.67 81.78 0.13 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.539 -178.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.43 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 90.3 mt -116.8 95.36 46.33 Favored Pre-proline 0 C--N 1.325 -0.466 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 177.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.43 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 21.0 Cg_endo -61.73 127.27 21.1 Favored 'Trans proline' 0 C--N 1.345 0.36 0 C-N-CA 122.798 2.332 . . . . 0.0 111.405 179.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.412 HG21 ' CE ' ' A' ' 162' ' ' LYS . 10.8 p -137.76 177.72 7.66 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.221 -174.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 171' ' ' PRO . 94.1 mtt180 -93.39 146.2 31.41 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 116.074 -0.512 . . . . 0.0 109.861 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 24.7 Cg_exo -63.77 146.24 91.74 Favored 'Trans proline' 0 C--O 1.235 0.334 0 C-N-CA 122.761 2.307 . . . . 0.0 111.908 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.15 7.08 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.314 -178.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.4 mt -74.38 145.08 44.07 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.948 0.404 . . . . 0.0 111.297 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.58 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 13.9 m120 -121.42 174.96 6.42 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.258 178.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.632 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.7 tptm -54.88 -53.1 59.8 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 123.473 0.483 . . . . 0.0 111.371 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.38 -39.01 85.72 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.675 0.274 . . . . 0.0 111.196 -178.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -62.12 -46.29 89.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.271 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 84.7 mt -59.05 -49.68 76.97 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.513 179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.632 HG23 ' O ' ' A' ' 175' ' ' LYS . 39.0 t -58.73 -40.54 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.344 -176.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.4 mt-10 -64.72 -49.17 71.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.929 178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.32 -47.82 88.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.821 -179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 74.5 t -59.24 -47.71 89.4 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.388 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.177 177.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . 0.5 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -62.45 -38.96 97.18 Favored Glycine 0 N--CA 1.448 -0.508 0 C-N-CA 121.183 -0.532 . . . . 0.0 112.671 -179.054 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.46 -41.94 99.11 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.799 0.333 . . . . 0.0 110.513 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 45.5 t-80 -81.04 -31.6 34.44 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.651 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 77.1 t80 -64.98 -27.87 69.13 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 122.87 0.468 . . . . 0.0 110.922 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 63.5 mttp -72.8 -6.71 46.67 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.34 177.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.9 t -133.09 60.74 1.7 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.351 0.596 . . . . 0.0 110.704 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.974 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 68.8 mt -110.75 119.0 47.37 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.169 175.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -68.01 129.24 19.12 Favored 'Trans proline' 0 C--O 1.235 0.338 0 C-N-CA 123.074 2.516 . . . . 0.0 111.214 175.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.0 p -142.45 154.65 18.25 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.696 -173.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -134.42 122.01 21.93 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 -178.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.638 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 29.0 tt0 -48.79 -64.13 0.89 Allowed 'General case' 0 N--CA 1.467 0.414 0 O-C-N 123.413 0.445 . . . . 0.0 112.146 -173.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -56.86 -53.04 62.5 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.521 -172.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -66.88 -42.13 86.09 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.712 -176.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.7 m -64.92 -40.79 95.61 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.978 -179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 52.5 mt -63.38 -43.9 96.29 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 53.9 m -58.58 -48.99 79.08 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.097 179.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 74.7 m -58.36 -48.73 79.65 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-O 120.863 0.364 . . . . 0.0 110.704 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.532 ' CD1' HD22 ' B' ' 488' ' ' LEU . 42.2 t80 -57.33 -55.65 32.07 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.079 179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.544 HD11 ' HE2' ' B' ' 468' ' ' PHE . 85.4 mt -57.64 -45.48 86.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.243 0.544 . . . . 0.0 110.57 -178.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 22.1 t80 -60.88 -59.83 4.75 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.191 -176.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 68.8 m -62.36 -45.4 93.33 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -174.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.537 HG11 HD23 ' B' ' 523' ' ' LEU . 51.6 t -67.39 -35.32 73.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 C-N-CA 120.529 -0.468 . . . . 0.0 111.37 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 58.1 mtp180 -77.46 -13.89 59.82 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.788 -0.365 . . . . 0.0 111.109 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -103.48 -80.58 0.52 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.979 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -121.42 107.0 11.95 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.857 0.836 . . . . 0.0 111.097 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -75.46 90.03 2.69 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.931 -1.031 . . . . 0.0 110.434 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 7.5 t30 63.77 85.82 0.13 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.369 -178.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.603 ' HE2' ' HB2' ' A' ' 212' ' ' ASP . 87.2 tttt -81.71 139.3 34.98 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.701 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 5.8 p -80.03 -73.75 0.34 Allowed 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 121.197 -0.201 . . . . 0.0 110.73 -179.161 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.603 ' HB2' ' HE2' ' A' ' 210' ' ' LYS . 30.0 t70 47.06 84.48 0.03 OUTLIER 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.516 0.674 . . . . 0.0 112.003 179.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.88 108.75 14.81 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.744 -177.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 27.5 tptp -151.6 135.42 16.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.232 179.413 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -91.03 129.26 37.05 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.777 0.322 . . . . 0.0 110.201 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -84.7 -71.48 0.52 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.457 -179.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 8.2 m -83.67 115.89 22.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.803 -175.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -78.8 75.77 1.97 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.916 -0.659 . . . . 0.0 111.939 177.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 11.2 p -74.85 -29.42 22.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 121.039 0.447 . . . . 0.0 110.703 -177.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 84.4 t60 . . . . . 0 C--O 1.247 0.952 0 CA-C-O 118.643 -0.694 . . . . 0.0 109.615 179.875 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 48.0 m . . . . . 0 N--CA 1.477 0.911 0 CA-C-O 120.544 0.212 . . . . 0.0 110.782 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 11.9 m120 61.84 27.57 16.82 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.905 -0.588 . . . . 0.0 112.034 175.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -99.03 -75.31 0.56 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.724 0.297 . . . . 0.0 110.97 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 7.7 p -90.71 34.42 0.9 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.208 0.528 . . . . 0.0 111.066 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -101.98 -71.69 0.71 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.184 -177.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 16.9 t60 -113.72 -36.64 4.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.776 -176.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -73.32 -72.74 0.95 Allowed Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.286 178.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . 0.638 HG13 ' HB2' ' B' ' 464' ' ' GLU . 71.0 t -81.35 120.64 33.37 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-O 120.715 0.293 . . . . 0.0 110.344 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -133.1 -67.69 0.08 OUTLIER Glycine 0 N--CA 1.446 -0.674 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.342 -177.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 11.6 t -74.46 -25.39 59.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.13 0.491 . . . . 0.0 110.398 -178.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.638 ' HB2' HG13 ' B' ' 461' ' ' VAL . 2.9 mp0 -66.6 -44.0 83.29 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 176.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 10.7 t -65.24 -33.28 75.63 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 178.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.438 ' HB3' ' O ' ' B' ' 463' ' ' THR . 53.9 tp -60.73 -49.22 78.36 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.992 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.492 ' O ' HG23 ' B' ' 471' ' ' VAL . 78.1 t80 -55.78 -51.74 66.37 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.364 176.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.544 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.7 m-85 -65.45 -34.97 79.53 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.655 -0.248 . . . . 0.0 111.535 -176.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.62 -45.44 94.06 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 175.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -58.85 -48.75 80.26 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.812 176.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.492 HG23 ' O ' ' B' ' 467' ' ' PHE . 63.3 t -58.92 -47.07 90.82 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 120.875 0.369 . . . . 0.0 110.658 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -61.35 -39.37 90.36 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.299 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 25.4 tttp -79.85 -30.77 40.41 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.196 -175.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.457 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -80.0 -47.69 14.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.611 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . 0.442 HD21 ' HB3' ' B' ' 508' ' ' PHE . 24.9 mt -66.53 -40.39 89.11 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.371 -178.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 71.25 -46.05 0.63 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 123.525 0.73 . . . . 0.0 112.692 173.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 33.8 t -72.13 136.68 46.6 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.671 0.272 . . . . 0.0 110.493 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.21 -43.82 97.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.823 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -71.55 -29.65 64.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.615 -178.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.475 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -68.34 -42.38 79.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.958 0.408 . . . . 0.0 110.425 178.052 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -67.48 -37.36 82.76 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 176.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.553 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 44.6 tt0 -60.26 -42.1 94.64 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.74 174.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.475 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 19.5 t-20 -53.59 -49.16 68.35 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.277 176.187 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -54.07 -47.69 71.41 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.29 0.567 . . . . 0.0 110.507 176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.01 -31.62 72.29 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.134 -179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.974 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 17.1 mtt85 -67.49 -37.55 83.01 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.92 0.39 . . . . 0.0 110.258 177.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.4 m -62.17 -36.37 81.67 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.4 mt -66.46 -47.43 73.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.287 179.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.538 HG22 ' HA ' ' B' ' 486' ' ' ARG . 12.6 m -64.7 -42.45 95.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 120.756 -0.377 . . . . 0.0 111.902 -177.371 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.422 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 26.1 pt -69.22 -31.27 49.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.14 0 C-N-CA 120.086 -0.646 . . . . 0.0 110.988 179.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 82.2 t80 -63.96 -45.74 87.76 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 171.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -64.49 -35.94 82.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.788 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -81.92 17.57 1.52 Allowed 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.693 -179.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 64.22 29.54 13.84 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.076 0.465 . . . . 0.0 111.064 172.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.593 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 95.8 t -93.33 -55.12 6.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.377 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.404 ' HA ' HG23 ' A' ' 157' ' ' THR . 41.3 pt -104.35 149.49 8.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 C-N-CA 120.802 -0.359 . . . . 0.0 111.194 -176.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.43 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.1 m -78.64 173.77 12.09 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.512 179.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -57.78 -58.82 6.7 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 121.219 0.533 . . . . 0.0 111.076 -177.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . 0.661 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -60.81 -38.04 84.02 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.933 -179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 7.9 mm-40 -56.4 -38.3 71.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.195 177.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.9 tp -64.84 -52.46 56.56 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.942 177.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.661 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -62.72 -40.66 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 CA-C-O 120.84 0.353 . . . . 0.0 110.929 -178.773 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.7 mt-30 -67.48 -37.74 83.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.422 -178.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.73 HD11 HD23 ' A' ' 150' ' ' LEU . 10.7 tp -62.37 -41.78 98.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.746 0.308 . . . . 0.0 111.181 -174.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 18.0 m -86.11 14.24 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.855 -179.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.585 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 48.3 t -57.53 -51.41 81.91 Favored Pre-proline 0 CA--C 1.539 0.533 0 N-CA-C 111.753 0.279 . . . . 0.0 111.753 178.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.585 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.1 Cg_exo -61.38 -8.42 10.58 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.137 1.891 . . . . 0.0 112.738 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.442 ' HB3' HD21 ' B' ' 475' ' ' LEU . 88.2 m-85 -106.58 -61.5 1.52 Allowed 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.302 -177.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.49 HD21 HG13 ' B' ' 471' ' ' VAL . 46.4 mt -95.72 -14.9 23.01 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.364 -173.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.21 -19.62 68.43 Favored Glycine 0 N--CA 1.454 -0.118 0 C-N-CA 121.145 -0.55 . . . . 0.0 112.744 -176.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.8 mttm -71.04 -21.58 62.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.29 0.567 . . . . 0.0 110.185 178.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.477 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 45.7 m-85 -115.76 98.11 50.32 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.244 -175.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . 0.477 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.8 Cg_endo -54.17 -46.36 34.16 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 123.398 2.732 . . . . 0.0 113.211 -176.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -61.81 -38.5 88.36 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.175 0.512 . . . . 0.0 110.892 -179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.426 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 33.3 tp -74.48 -47.09 35.35 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.546 -176.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 11.8 t80 -69.36 -32.22 71.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.738 -178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -70.14 -40.32 74.87 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.226 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 12.5 t90 -54.84 -48.36 72.98 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 174.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.609 ' O ' ' HG ' ' B' ' 523' ' ' LEU . 8.4 t80 -56.79 -49.71 74.53 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.652 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.604 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 94.8 mttt -59.01 -44.74 91.73 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.529 178.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -64.14 -35.24 80.13 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.812 -178.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 70.7 t80 -71.79 -38.9 70.2 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.569 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.609 ' HG ' ' O ' ' B' ' 519' ' ' PHE . 68.0 mt -77.1 -13.45 59.95 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.221 -178.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 70.36 43.46 62.3 Favored Glycine 0 N--CA 1.445 -0.755 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -173.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 46.5 t80 -81.61 98.22 8.24 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.987 0.422 . . . . 0.0 109.998 -177.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -67.73 -76.19 0.09 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.642 -0.708 . . . . 0.0 111.323 -178.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 58.76 19.08 6.54 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.533 -177.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 C--O 1.247 0.964 0 CA-C-N 115.33 -0.85 . . . . 0.0 109.71 -176.859 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 N--CA 1.477 0.897 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 65.66 -176.77 0.18 Allowed 'General case' 0 N--CA 1.465 0.313 0 C-N-CA 123.023 0.529 . . . . 0.0 111.177 -179.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -157.14 -169.26 2.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.07 -178.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -88.68 -148.36 16.94 Favored Glycine 0 N--CA 1.442 -0.945 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.176 174.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 12.6 p -95.06 -3.65 47.81 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.364 0.602 . . . . 0.0 109.902 176.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -122.34 131.13 53.75 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.415 -174.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -107.75 103.94 13.33 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.109 0.481 . . . . 0.0 110.564 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -107.57 112.17 24.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.062 178.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -165.69 101.86 0.19 Allowed Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.833 -0.698 . . . . 0.0 112.104 -178.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -156.12 80.41 0.18 Allowed Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 -178.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -69.58 -40.63 76.62 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.749 0.309 . . . . 0.0 110.858 -178.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 9.3 t -149.86 106.46 3.23 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -179.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_endo -69.68 125.01 11.69 Favored 'Trans proline' 0 C--O 1.233 0.262 0 C-N-CA 122.677 2.251 . . . . 0.0 112.168 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 33.2 m -74.77 155.79 6.34 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.532 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.781 178.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -101.63 77.23 1.73 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.337 0.589 . . . . 0.0 109.746 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -83.93 -28.52 27.8 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.895 -177.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.445 HG22 ' O ' ' A' ' 143' ' ' ILE . 36.1 mt 72.81 11.5 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.443 177.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.586 ' O ' ' HB ' ' A' ' 145' ' ' THR . 28.5 t70 59.93 10.07 2.0 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 114.232 -1.349 . . . . 0.0 111.734 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . 0.586 ' HB ' ' O ' ' A' ' 144' ' ' ASP . 25.0 m 73.45 110.5 0.03 OUTLIER Pre-proline 0 C--N 1.326 -0.443 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.434 -172.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.442 ' HB2' ' CD2' ' B' ' 508' ' ' PHE . 32.4 Cg_exo -57.07 136.29 75.76 Favored 'Trans proline' 0 C--N 1.345 0.388 0 C-N-CA 122.453 2.102 . . . . 0.0 111.392 174.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -110.06 166.07 11.23 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.667 -176.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.532 HG12 ' ND2' ' B' ' 483' ' ' ASN . 6.8 p -114.01 140.48 34.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.861 176.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 12.5 t70 -106.33 124.52 49.72 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.361 -0.607 . . . . 0.0 109.361 177.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.433 HD13 HG12 ' A' ' 182' ' ' VAL . 61.7 mt -104.05 2.53 32.25 Favored 'General case' 0 C--N 1.319 -0.761 0 CA-C-O 121.393 0.616 . . . . 0.0 110.624 -177.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 58.7 t80 -86.39 -21.92 26.89 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.356 -0.838 . . . . 0.0 108.758 177.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.45 HE21 ' HB3' ' B' ' 503' ' ' GLN . 19.0 pt20 -73.34 -17.57 61.28 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.241 -0.891 . . . . 0.0 110.835 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.466 HD11 HD21 ' B' ' 504' ' ' LEU . 76.2 mt -75.1 173.1 11.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.269 0.557 . . . . 0.0 111.621 -178.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -87.6 144.8 26.5 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.33 175.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.549 HG13 ' CD1' ' A' ' 178' ' ' LEU . 55.3 t -54.08 -42.26 54.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.201 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.516 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -58.69 -35.41 72.58 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.145 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 23.6 m -69.83 -42.02 74.19 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.767 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.474 ' O ' ' HG3' ' A' ' 162' ' ' LYS . 74.7 mt -64.56 -40.94 96.47 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.226 178.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 159' ' ' ARG . 27.9 mtp85 -64.71 -37.42 87.52 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.594 177.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 160' ' ' ARG . 35.2 ttm105 -66.25 -38.85 88.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.446 179.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.487 ' HA ' HG13 ' B' ' 495' ' ' VAL . 60.4 t80 -56.44 -51.52 68.08 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.275 172.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.635 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 7.4 mtpm? -60.97 -35.19 76.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.457 -177.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -76.43 -34.91 58.76 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.929 -176.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -77.16 -42.4 37.93 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.338 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.43 ' CE1' HG22 ' B' ' 490' ' ' ILE . 58.2 m-85 -89.63 3.01 53.96 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.465 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp 54.5 74.57 0.34 Allowed 'General case' 0 N--CA 1.468 0.435 0 O-C-N 123.7 0.625 . . . . 0.0 111.307 176.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.635 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 84.8 mt -111.05 144.56 30.64 Favored Pre-proline 0 C--N 1.328 -0.353 0 C-N-CA 120.989 -0.284 . . . . 0.0 111.093 -177.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -65.47 162.58 33.26 Favored 'Trans proline' 0 C--O 1.237 0.458 0 C-N-CA 122.996 2.464 . . . . 0.0 112.041 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.5 p -140.88 179.01 6.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.949 0.404 . . . . 0.0 111.286 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 31.5 ptt180 -144.84 145.69 28.69 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 177.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -57.52 128.25 28.61 Favored 'Trans proline' 0 C--O 1.236 0.402 0 C-N-CA 122.667 2.244 . . . . 0.0 112.177 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 99.24 39.38 3.51 Favored Glycine 0 N--CA 1.446 -0.687 0 C-N-CA 120.97 -0.633 . . . . 0.0 112.136 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 75.2 mt -65.76 155.4 36.27 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.122 0.486 . . . . 0.0 111.337 178.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.47 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 8.2 t-20 -154.63 -171.67 3.93 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 178.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.651 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.4 tptm -64.09 -62.1 1.84 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 117.731 0.241 . . . . 0.0 111.251 -176.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.21 -30.13 64.3 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.701 0.286 . . . . 0.0 111.383 -177.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 8.9 mm-40 -59.02 -55.29 37.1 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.67 0.748 . . . . 0.0 110.393 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.549 ' CD1' HG13 ' A' ' 155' ' ' VAL . 53.4 mt -64.29 -41.56 96.83 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 114.94 -1.027 . . . . 0.0 110.661 -177.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.651 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.6 t -60.48 -37.92 76.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.773 -178.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -64.99 -53.26 48.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.874 176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.426 HG21 ' HE2' ' A' ' 162' ' ' LYS . 55.3 mt -60.32 -49.33 84.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.673 0 CA-C-O 121.01 0.433 . . . . 0.0 110.744 -178.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.433 HG12 HD13 ' A' ' 150' ' ' LEU . 77.5 t -59.17 -49.09 84.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.283 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.939 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.58 -37.32 94.0 Favored Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.439 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 29.1 t -61.97 -42.36 99.04 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.93 0.395 . . . . 0.0 110.907 -179.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.3 t-80 -87.26 -25.11 24.13 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 120.378 -0.529 . . . . 0.0 111.387 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.413 ' CE2' HG11 ' A' ' 148' ' ' VAL . 73.9 t80 -62.22 -43.58 98.51 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.104 0.478 . . . . 0.0 110.651 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -80.94 8.13 9.07 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.566 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 3.2 p -125.12 14.18 8.4 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 120.805 0.336 . . . . 0.0 111.274 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.442 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 75.6 mt -79.58 120.75 81.24 Favored Pre-proline 0 C--O 1.235 0.321 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.55 178.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_exo -70.99 115.96 4.49 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.994 2.463 . . . . 0.0 111.294 175.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.475 HG21 ' HB3' ' B' ' 485' ' ' LEU . 3.8 p -127.89 156.21 39.72 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.068 -174.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.538 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 18.9 m120 -128.97 138.33 51.89 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.729 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 27.1 tt0 -55.54 -67.28 0.3 Allowed 'General case' 0 CA--C 1.531 0.22 0 N-CA-C 112.481 0.549 . . . . 0.0 112.481 -173.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 65.9 tttp -72.7 -36.47 67.84 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.777 0.322 . . . . 0.0 110.965 -172.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 12.1 t70 -55.25 -49.6 71.63 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.993 179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 90.4 m -75.54 -35.35 60.7 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.501 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.729 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 35.7 mt -58.45 -46.62 86.17 Favored 'General case' 0 C--N 1.334 -0.105 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.9 m -61.49 -43.53 98.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.888 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.0 m -58.08 -50.99 71.54 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 120.875 0.369 . . . . 0.0 111.013 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.453 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.2 t80 -65.1 -47.13 78.32 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.574 -175.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 197' ' ' LEU . 77.5 mt -61.95 -45.71 98.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.24 0 CA-C-O 120.749 0.309 . . . . 0.0 111.034 -176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -66.42 -35.96 81.61 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.496 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.9 m -62.41 -61.33 2.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.015 178.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.63 HG13 ' HG2' ' A' ' 208' ' ' LYS . 99.4 t -61.91 -39.71 84.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.855 -174.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -73.59 -9.7 58.95 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 120.778 -0.369 . . . . 0.0 111.742 -178.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.23 -72.15 0.73 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.878 0.37 . . . . 0.0 110.214 177.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 30.7 t0 -144.55 116.46 8.29 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 174.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.63 ' HG2' HG13 ' A' ' 204' ' ' VAL . 85.4 mttt -70.81 -56.51 6.17 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.884 -168.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 179.67 117.52 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.42 145.31 18.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.252 0.548 . . . . 0.0 111.523 178.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . 0.626 ' HB3' ' HB3' ' A' ' 214' ' ' LYS . 15.7 m -137.52 112.14 8.79 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.213 -175.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -106.98 120.92 43.37 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 34.1 tp 61.59 64.12 1.09 Allowed 'General case' 0 C--N 1.332 -0.19 0 CA-C-O 121.625 0.726 . . . . 0.0 109.438 -176.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . 0.858 ' H ' ' HD3' ' A' ' 214' ' ' LYS . 0.0 OUTLIER -98.27 -50.09 4.46 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.214 -171.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . 0.423 ' N ' ' HG2' ' A' ' 214' ' ' LYS . . . -173.36 -50.94 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.507 0.194 . . . . 0.0 111.071 -174.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 67.38 27.26 8.2 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.224 179.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.5 m -129.19 151.5 49.79 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.452 -176.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 101.62 -140.11 14.72 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.667 -0.778 . . . . 0.0 111.5 -179.317 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 26.8 m -111.84 -7.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-O 120.986 0.422 . . . . 0.0 110.851 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.166 -0.921 . . . . 0.0 110.021 -179.27 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 12.5 p . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.83 0.348 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 64.0 t30 -82.14 -40.38 21.92 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.085 0.469 . . . . 0.0 110.049 178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -67.65 167.18 13.6 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.743 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 39.9 t -114.39 140.9 48.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.7 0.286 . . . . 0.0 110.436 -177.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -75.42 -42.89 52.46 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.3 177.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.5 m-70 -85.6 -29.31 24.2 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.811 178.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 89.65 -50.32 3.49 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.863 176.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 27.3 m -117.75 161.29 16.72 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 120.844 0.354 . . . . 0.0 111.137 -177.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -157.51 50.84 0.42 Allowed Glycine 0 N--CA 1.448 -0.522 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.655 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.5 t -70.37 -23.35 62.77 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.492 0.187 . . . . 0.0 111.329 -176.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -63.59 -53.63 48.59 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -60.67 -33.45 72.85 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.606 177.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.3 tp -61.32 -50.7 71.88 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.247 176.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.464 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.5 t80 -52.62 -51.31 60.59 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.774 175.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.414 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 60.4 m-85 -65.02 -34.61 78.83 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -175.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -65.53 -38.16 88.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.935 0.398 . . . . 0.0 110.134 176.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -63.95 -47.06 81.95 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.223 175.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.489 HG13 HD21 ' B' ' 509' ' ' LEU . 75.2 t -58.74 -45.24 91.22 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 110.465 177.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 54.0 ttp180 -59.33 -38.06 79.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.128 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 51.7 tttm -79.01 -41.38 29.08 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.183 179.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.536 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -67.27 -43.41 81.9 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.014 -0.539 . . . . 0.0 112.184 -174.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.9 mp -68.02 -30.65 69.93 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.095 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 69.23 -59.94 0.47 Allowed 'General case' 0 N--CA 1.47 0.526 0 O-C-N 123.942 0.776 . . . . 0.0 112.104 176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 32.8 t -69.06 135.09 50.26 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.238 -176.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.64 -36.17 81.93 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.245 178.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -68.27 -39.24 82.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.259 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.419 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.31 -45.85 89.43 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.104 0.478 . . . . 0.0 110.326 177.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.43 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 55.3 t80 -66.81 -31.5 72.16 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.113 177.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.663 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 33.5 tt0 -65.49 -42.94 91.63 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.668 176.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.532 ' ND2' HG12 ' A' ' 148' ' ' VAL . 5.5 m-20 -55.67 -46.28 77.58 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.817 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -55.94 -46.79 78.41 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.433 176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.475 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.5 mt -67.73 -32.69 73.48 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.291 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.663 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -61.3 -41.33 96.8 Favored 'General case' 0 CA--C 1.518 -0.258 0 CA-C-O 120.815 0.341 . . . . 0.0 110.183 173.381 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.6 m -62.48 -35.49 79.51 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.224 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.453 HD22 ' CG ' ' A' ' 200' ' ' PHE . 40.2 mt -68.51 -47.19 67.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.435 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.4 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.5 m -65.33 -40.81 89.67 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 C-N-CA 120.827 -0.349 . . . . 0.0 111.665 -177.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.8 pt -69.44 -32.96 55.1 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.735 178.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -65.18 -42.79 93.31 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.21 0.529 . . . . 0.0 109.727 173.186 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -60.19 -38.23 82.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.87 178.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -86.79 15.95 5.28 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.475 -178.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 60.5 26.34 15.98 Favored 'General case' 0 N--CA 1.466 0.375 0 C-N-CA 122.752 0.421 . . . . 0.0 111.631 177.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.487 HG13 ' HA ' ' A' ' 161' ' ' TYR . 53.6 t -77.13 -48.48 24.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 121.13 0.49 . . . . 0.0 109.979 177.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.571 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 38.4 pt -113.3 155.58 14.48 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.997 179.451 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.453 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 81.4 p -96.27 -173.32 2.76 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 178.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . . . . . . . . . 74.4 mtm-85 -54.88 -59.54 4.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.671 -0.24 . . . . 0.0 111.0 179.542 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . 0.439 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -58.6 -40.51 83.46 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.962 -173.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.571 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 6.7 mm-40 -59.19 -44.0 92.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.425 0.631 . . . . 0.0 109.908 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.515 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -62.3 -46.07 90.39 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.226 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.439 HG23 ' HA ' ' B' ' 499' ' ' ALA . 0.0 OUTLIER -67.2 -32.9 59.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 C-N-CA 120.905 -0.318 . . . . 0.0 110.728 -178.139 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.45 ' HB3' HE21 ' A' ' 152' ' ' GLN . 87.2 mt-30 -71.57 -39.9 70.29 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.466 HD21 HD11 ' A' ' 153' ' ' LEU . 74.9 mt -65.05 -38.73 91.76 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 120.885 0.374 . . . . 0.0 111.891 -177.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 34.9 m -84.92 11.41 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.583 -179.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.642 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 43.8 t -61.03 -52.21 73.64 Favored Pre-proline 0 CA--C 1.541 0.607 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.865 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 32.2 Cg_exo -63.61 -15.93 51.62 Favored 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 121.898 1.732 . . . . 0.0 112.378 178.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.442 ' CD2' ' HB2' ' A' ' 146' ' ' PRO . 94.9 m-85 -90.56 -65.73 0.99 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.082 -178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.489 HD21 HG13 ' B' ' 471' ' ' VAL . 87.9 mt -92.33 -5.13 52.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.438 -173.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.64 -17.1 68.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.956 -0.64 . . . . 0.0 112.431 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 48.4 mttm -72.57 -21.1 61.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.392 -0.595 . . . . 0.0 109.392 176.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.536 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 22.6 m-85 -123.28 86.47 51.71 Favored Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.682 -176.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -50.7 -46.49 29.73 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 123.155 2.57 . . . . 0.0 113.185 -174.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -65.07 -37.55 87.89 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.871 0.367 . . . . 0.0 111.249 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 20.7 tp -70.4 -38.73 74.7 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.296 0.57 . . . . 0.0 109.794 -179.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.601 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 54.0 t80 -65.38 -35.39 80.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.828 176.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 85.6 m-20 -70.01 -32.86 71.24 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.057 176.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -59.14 -48.85 80.07 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 173.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -56.28 -46.7 79.63 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.289 -0.868 . . . . 0.0 110.522 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.601 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 92.6 mttt -60.64 -41.01 94.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.186 176.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -61.58 -30.56 70.75 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.991 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.6 t80 -75.92 -39.32 56.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.286 0.565 . . . . 0.0 109.928 -177.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.515 HD21 HD23 ' B' ' 501' ' ' LEU . 10.2 mp -80.76 -24.64 38.53 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.074 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 95.03 30.55 8.24 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.695 -0.764 . . . . 0.0 111.787 -179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . 0.463 ' HD1' ' H ' ' B' ' 527' ' ' GLU . 0.2 OUTLIER -86.4 92.95 8.99 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 -179.143 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' B' ' 526' ' ' LYS . 1.8 tppp? -95.65 28.04 3.19 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.403 -176.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . 0.463 ' H ' ' HD1' ' B' ' 525' ' ' TYR . 15.6 mm-40 60.82 25.68 15.56 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.308 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 51.5 p . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.459 -0.781 . . . . 0.0 110.145 179.719 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 20.4 p . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 120.472 0.177 . . . . 0.0 111.021 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 63.0 25.84 15.23 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.163 0.506 . . . . 0.0 110.815 -178.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -86.3 108.02 18.22 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.373 179.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 171.77 179.6 42.87 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 121.054 -0.593 . . . . 0.0 111.789 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 34.8 t -144.74 163.74 33.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.866 0.365 . . . . 0.0 110.533 -177.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -100.26 -1.67 35.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.06 -0.518 . . . . 0.0 109.906 176.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 42.27 -101.42 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 115.04 -0.982 . . . . 0.0 113.06 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.5 t70 54.29 79.06 0.14 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.445 0.64 . . . . 0.0 110.603 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 99.88 -74.49 0.46 Allowed Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.44 -0.8 . . . . 0.0 111.455 -176.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 95.34 46.24 2.83 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.697 179.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -72.47 108.73 5.7 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.938 0.399 . . . . 0.0 110.447 -178.306 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.536 ' HB2' ' HB3' ' A' ' 141' ' ' GLN . 14.8 m -83.97 131.15 52.31 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.098 -178.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -53.68 -55.43 3.55 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.746 2.297 . . . . 0.0 111.868 178.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.968 ' HB ' ' HG2' ' B' ' 511' ' ' LYS . 39.0 t -116.53 103.33 14.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 177.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.536 ' HB3' ' HB2' ' A' ' 138' ' ' SER . 26.8 pt20 -128.52 -179.57 5.12 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.674 -0.694 . . . . 0.0 110.326 -178.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 24.0 t70 64.91 101.92 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.502 0 O-C-N 123.872 0.733 . . . . 0.0 110.987 -178.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.498 ' O ' ' HD3' ' B' ' 476' ' ' ARG . 0.7 OUTLIER -148.38 137.38 15.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.217 -177.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.434 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.8 t70 -111.45 -47.77 3.15 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 172.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 34.1 m -151.73 96.02 3.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.916 178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -72.05 155.12 57.48 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.187 1.925 . . . . 0.0 111.737 176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -128.29 137.04 51.78 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.131 0.491 . . . . 0.0 111.714 -172.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.46 133.59 28.91 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.086 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -87.38 -26.81 23.14 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.215 0.531 . . . . 0.0 111.109 -177.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 74.6 mt 64.15 13.77 8.08 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.227 179.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -88.14 -16.03 34.53 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.05 -174.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.8 -15.08 60.3 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.559 -0.291 . . . . 0.0 111.328 177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.415 HD22 HG21 ' A' ' 157' ' ' THR . 81.2 mt -67.44 140.4 57.12 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.53 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 22.6 mm-40 -70.19 157.83 36.91 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.976 -0.556 . . . . 0.0 109.797 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 88.7 t -56.16 -44.17 78.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-O 120.928 0.394 . . . . 0.0 110.855 -179.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 -64.31 -36.58 84.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.808 -178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.415 HG21 HD22 ' A' ' 153' ' ' LEU . 10.4 m -63.58 -46.58 85.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.08 0.467 . . . . 0.0 110.629 179.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.462 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 68.5 mt -62.48 -42.73 99.69 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.743 178.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 66.4 mtp85 -70.08 -28.81 65.73 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.86 179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.503 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 33.7 ttm180 -72.34 -44.6 62.39 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.513 ' HA ' HG13 ' B' ' 495' ' ' VAL . 57.7 t80 -51.98 -51.22 58.69 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.081 172.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.695 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 19.8 mtpp -65.97 -29.73 70.18 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.279 -177.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 58.5 ttp180 -81.84 -42.67 19.29 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 120.471 -0.492 . . . . 0.0 110.701 179.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 42.9 t-80 -68.39 -32.77 73.07 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.874 -175.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 73.1 m-85 -95.7 0.11 52.19 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.151 178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 57.64 77.53 0.27 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.729 -0.669 . . . . 0.0 112.016 179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 77.0 mt -120.67 134.85 24.31 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.78 177.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.75 155.15 65.23 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 122.908 2.405 . . . . 0.0 113.114 -173.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.639 ' HB ' HD11 ' A' ' 173' ' ' LEU . 67.8 p -138.56 -179.56 5.88 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.358 176.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.5 ppt_? -165.18 159.26 14.35 Favored Pre-proline 0 C--N 1.327 -0.41 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 177.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -54.38 131.5 45.63 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.75 2.3 . . . . 0.0 112.557 179.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 108.05 31.67 3.52 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.86 -0.686 . . . . 0.0 111.916 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.639 HD11 ' HB ' ' A' ' 169' ' ' THR . 79.6 mt -80.92 140.15 35.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.217 0.532 . . . . 0.0 111.008 179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.584 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 93.2 m-20 -131.11 172.95 11.52 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.184 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.594 ' O ' HG23 ' A' ' 179' ' ' VAL . 21.5 tptm -56.39 -53.9 51.93 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 123.353 0.408 . . . . 0.0 110.339 176.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . 0.597 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -62.05 -34.21 75.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.423 -178.715 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.584 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.6 mm100 -67.03 -41.74 86.06 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.032 0.444 . . . . 0.0 110.879 -178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 88.0 mt -61.22 -47.87 84.12 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.837 176.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.594 HG23 ' O ' ' A' ' 175' ' ' LYS . 35.6 t -60.19 -32.61 50.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.801 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 13.2 mm-40 -61.97 -57.45 11.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 110.691 175.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.695 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 38.6 mt -61.69 -43.2 96.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.504 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.676 -178.147 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 178' ' ' LEU . 71.8 t -59.64 -49.0 85.35 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.33 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.316 177.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.2 -40.86 99.54 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 121.018 -0.611 . . . . 0.0 112.314 179.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 41.2 t -55.85 -42.73 76.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.786 0.327 . . . . 0.0 111.195 178.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 -86.38 -30.49 22.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.873 0.368 . . . . 0.0 111.3 -179.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 64.2 t80 -63.87 -32.01 73.38 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.145 -177.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -79.63 14.64 1.59 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.54 179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 43.0 m -147.45 34.86 0.87 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.692 0.282 . . . . 0.0 111.457 -179.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.908 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 72.4 mt -93.31 114.92 64.16 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.752 -0.203 . . . . 0.0 110.613 178.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -64.29 127.24 18.69 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.67 2.247 . . . . 0.0 110.892 174.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.414 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 9.0 p -144.61 149.76 16.94 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.613 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.739 -174.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.694 ' HB2' ' HB3' ' A' ' 195' ' ' ASP . 12.6 m-80 -112.52 155.42 24.34 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 179.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.528 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.1 tt0 -71.64 -66.68 0.6 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 -178.042 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 28.3 tptp -73.49 -43.79 59.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.253 -172.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . 0.694 ' HB3' ' HB2' ' A' ' 192' ' ' ASN . 15.0 t70 -52.64 -48.4 66.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.998 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 36.7 m -71.3 -42.76 68.25 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.338 -176.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 55.0 mt -56.8 -45.94 81.91 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.844 0.354 . . . . 0.0 110.147 177.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 18.2 m -62.19 -43.25 99.24 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.906 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 79.4 m -59.8 -49.86 76.07 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 120.865 0.364 . . . . 0.0 110.918 178.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.541 ' CG ' HD22 ' B' ' 488' ' ' LEU . 76.6 t80 -60.86 -55.31 34.53 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.826 -179.258 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.505 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 76.0 mt -54.35 -50.41 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.669 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 20.6 t80 -58.34 -43.34 88.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.782 -176.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.7 m -64.49 -43.82 92.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.488 -179.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.541 HG23 ' O ' ' A' ' 200' ' ' PHE . 17.8 t -73.5 -22.29 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 CA-C-O 121.34 0.591 . . . . 0.0 110.562 -178.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.505 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 9.9 mmm180 -69.4 -32.05 70.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.138 172.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -84.98 -54.07 4.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.908 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.513 ' OD1' ' HA ' ' A' ' 211' ' ' SER . 11.4 t70 -141.8 -162.01 1.32 Allowed 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 -176.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.435 ' H ' ' CG ' ' A' ' 207' ' ' ASP . 32.8 mmtp -112.68 -16.64 12.76 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 109.867 -0.419 . . . . 0.0 109.867 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -154.42 -49.52 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.579 176.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -175.52 124.56 0.23 Allowed 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.096 -0.956 . . . . 0.0 108.657 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . 0.513 ' HA ' ' OD1' ' A' ' 207' ' ' ASP . 73.2 m -57.09 104.23 0.15 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.521 0.676 . . . . 0.0 112.037 -173.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -102.88 -70.57 0.75 Allowed 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.193 -0.912 . . . . 0.0 110.777 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . 0.486 ' HB3' ' HD3' ' A' ' 214' ' ' LYS . 51.4 tp 179.43 -45.16 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.128 -179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . 0.486 ' HD3' ' HB3' ' A' ' 213' ' ' LEU . 0.0 OUTLIER -131.36 51.54 2.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.809 -178.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -79.19 -18.38 53.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.689 0.757 . . . . 0.0 110.086 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -82.1 -52.25 7.19 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.12 -0.946 . . . . 0.0 110.368 177.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 47.5 t -170.58 -60.83 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.814 -179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 72.39 -79.39 0.66 Allowed Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.939 -0.648 . . . . 0.0 111.503 -176.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 15.0 p -124.18 -20.53 3.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 120.98 0.419 . . . . 0.0 110.22 177.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 . . . . . 0 C--O 1.244 0.814 0 CA-C-O 118.425 -0.798 . . . . 0.0 110.25 -177.805 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 N--CA 1.476 0.864 0 CA-C-O 120.93 0.395 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 22.4 m-80 -100.18 119.04 37.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.129 175.277 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -81.98 166.65 19.64 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.392 178.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 34.9 t -84.3 10.13 11.3 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.311 178.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 60.8 mttm 61.6 -153.27 0.36 Allowed 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.24 -178.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 -128.86 132.56 47.76 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.875 0.369 . . . . 0.0 110.792 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 135.44 104.69 0.78 Allowed Glycine 0 N--CA 1.445 -0.735 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.632 -177.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 32.7 m -80.65 -25.51 11.13 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-O 120.804 0.335 . . . . 0.0 110.864 -179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 134.12 -167.77 23.61 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 121.022 -0.609 . . . . 0.0 112.03 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.2 p -64.97 -15.71 62.55 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.989 0.423 . . . . 0.0 111.64 -178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.582 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.4 mp0 -57.17 -36.01 70.26 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.73 177.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 31.8 t -61.17 -43.04 99.5 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.224 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.412 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.4 tt -62.75 -46.01 90.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.139 -0.482 . . . . 0.0 109.728 177.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.573 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.5 t80 -52.88 -59.53 4.4 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.543 177.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.458 ' HE2' HD11 ' A' ' 201' ' ' ILE . 51.3 m-85 -65.18 -36.21 83.49 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.631 0.234 . . . . 0.0 111.631 -174.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -62.47 -45.18 94.21 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.351 0.596 . . . . 0.0 109.996 177.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . 0.434 ' HD2' HD13 ' B' ' 515' ' ' LEU . 23.6 ttmm -67.8 -40.85 83.86 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 115.327 -0.852 . . . . 0.0 110.637 178.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.573 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.2 t -56.21 -48.6 79.14 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.903 0.383 . . . . 0.0 110.462 175.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . 0.408 ' O ' ' HD3' ' B' ' 472' ' ' ARG . 1.5 tmt_? -57.07 -45.21 83.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.381 -178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -76.94 -37.04 56.08 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.666 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -69.61 -41.08 76.19 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -176.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.13 -32.56 73.98 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.573 -0.285 . . . . 0.0 110.422 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.498 ' HD3' ' O ' ' A' ' 143' ' ' ILE . 40.2 ttt180 69.28 -1.63 2.11 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 123.875 0.735 . . . . 0.0 111.875 173.169 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.434 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 21.4 t -127.14 131.31 50.79 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.773 -179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.23 -35.66 80.04 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.106 176.282 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -68.01 -37.87 81.94 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.342 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.474 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.24 -37.5 78.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.859 177.558 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 72.2 t80 -68.87 -37.69 79.23 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.003 0.43 . . . . 0.0 109.907 177.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.576 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.9 tt0 -61.37 -42.44 98.71 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 174.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.474 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 1.7 t-20 -52.21 -51.41 58.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.036 174.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 87.8 t80 -52.71 -47.62 67.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.682 177.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . . . . . . . . . 87.2 mt -67.03 -33.31 75.27 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.203 -179.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.908 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.8 mtt180 -66.37 -37.74 85.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.996 0.427 . . . . 0.0 110.3 176.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 84.1 m -61.18 -36.3 79.47 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.864 173.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.541 HD22 ' CG ' ' A' ' 200' ' ' PHE . 62.0 mt -68.89 -45.84 69.93 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.566 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.534 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -64.62 -42.31 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.478 -178.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.437 ' O ' ' HB ' ' B' ' 495' ' ' VAL . 17.6 pt -69.18 -32.02 52.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.406 -0.517 . . . . 0.0 110.608 179.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.0 t80 -64.85 -44.3 90.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.079 0.466 . . . . 0.0 109.987 172.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -68.85 -16.68 63.84 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.831 -178.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -101.37 16.49 25.42 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.27 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 65.56 10.84 6.99 Favored 'General case' 0 N--CA 1.471 0.595 0 O-C-N 123.425 0.453 . . . . 0.0 111.647 176.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.513 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.9 t -70.55 -47.22 66.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-O 120.915 0.388 . . . . 0.0 110.807 -176.703 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.6 pt -112.07 179.71 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.64 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.182 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 21.0 m -119.8 170.95 8.77 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.057 178.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.5 ' O ' HG23 ' B' ' 502' ' ' VAL . 55.6 ttp180 -50.57 -56.52 11.37 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.519 0.512 . . . . 0.0 111.384 178.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.34 -43.65 83.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.336 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.511 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 12.4 mm-40 -56.01 -49.0 74.87 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.362 178.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.459 ' C ' HD23 ' B' ' 501' ' ' LEU . 8.9 tt -61.64 -46.27 90.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.765 179.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.5 HG23 ' O ' ' B' ' 498' ' ' ARG . 90.2 t -59.76 -36.69 67.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.98 -178.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.3 mt-30 -82.32 -27.12 32.46 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.468 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 20.7 mt -65.0 -43.19 93.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.004 0.43 . . . . 0.0 111.528 179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.47 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.4 p -84.63 11.51 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.784 -0.643 . . . . 0.0 111.108 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.456 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 32.9 t -59.73 -50.07 88.61 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.158 -179.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.467 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 11.5 Cg_endo -60.56 -8.2 8.56 Favored 'Trans proline' 0 C--N 1.359 1.099 0 C-N-CA 122.255 1.97 . . . . 0.0 113.308 176.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.467 ' CE2' ' HG2' ' B' ' 507' ' ' PRO . 65.9 m-85 -110.45 -61.38 1.68 Allowed 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.732 -0.213 . . . . 0.0 111.249 -175.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.572 HD22 HD23 ' B' ' 515' ' ' LEU . 74.7 mt -96.93 -14.79 21.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.807 -0.179 . . . . 0.0 111.474 -174.54 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.8 -19.04 64.9 Favored Glycine 0 C--N 1.329 0.187 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.668 -176.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.968 ' HG2' ' HB ' ' A' ' 140' ' ' VAL . 8.0 mtpt -85.73 -3.81 59.0 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.694 0.283 . . . . 0.0 110.812 -179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.456 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 74.0 m-85 -122.98 95.11 46.57 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-N 116.087 -0.506 . . . . 0.0 109.69 179.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 8.2 Cg_endo -51.24 -50.75 12.92 Favored 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 123.21 2.606 . . . . 0.0 113.1 -174.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -60.73 -39.17 87.65 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.9 0.381 . . . . 0.0 111.577 -178.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.572 HD23 HD22 ' B' ' 509' ' ' LEU . 14.6 tp -78.13 -41.38 35.17 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.321 -173.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -66.96 -39.25 87.18 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.681 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -64.84 -36.19 83.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.615 177.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.582 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 8.7 t90 -59.4 -49.03 79.37 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 175.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.44 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.3 OUTLIER -62.48 -42.66 99.64 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.627 -177.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -61.96 -40.15 94.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.793 177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -63.42 -47.61 81.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.049 -179.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.2 t80 -65.91 -35.18 79.92 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.01 -176.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 86.4 mt -84.52 -9.23 58.53 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.657 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.08 41.18 61.04 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.88 -0.676 . . . . 0.0 112.203 -179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . 0.506 ' CE2' ' HB2' ' B' ' 527' ' ' GLU . 65.8 t80 -80.53 105.86 12.1 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 90.8 mttt -59.82 -71.02 0.14 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.715 -175.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . 0.506 ' HB2' ' CE2' ' B' ' 525' ' ' TYR . 43.4 tt0 64.58 92.03 0.07 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.149 -177.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 C--O 1.25 1.079 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.459 179.239 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 36.6 m . . . . . 0 N--CA 1.475 0.793 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 53.3 m-80 69.02 83.96 0.15 Allowed 'General case' 0 N--CA 1.463 0.213 0 O-C-N 123.74 0.65 . . . . 0.0 110.35 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -104.94 -22.75 13.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.435 -179.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 172.27 102.66 0.16 Allowed Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 120.839 -0.696 . . . . 0.0 111.738 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.2 m -75.58 -50.47 15.47 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.988 -0.375 . . . . 0.0 109.988 178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 35.8 t70 55.16 90.49 0.03 OUTLIER 'General case' 0 C--O 1.235 0.34 0 O-C-N 124.157 0.911 . . . . 0.0 111.985 177.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -66.08 -37.61 86.21 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.542 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -169.35 115.47 0.58 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.285 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -171.98 49.54 0.18 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.032 178.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -177.47 79.25 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.598 0 C-N-CA 120.72 -0.752 . . . . 0.0 112.075 -178.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -99.22 141.11 32.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.02 0.438 . . . . 0.0 110.537 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 24.4 m -96.63 119.87 63.08 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.445 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 5.5 Cg_exo -77.86 -159.38 0.1 OUTLIER 'Trans proline' 0 N--CA 1.462 -0.344 0 C-N-CA 123.16 2.573 . . . . 0.0 112.006 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.9 m -82.2 17.79 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-O 121.028 0.442 . . . . 0.0 111.168 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -170.24 -170.12 0.93 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 -179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 8.8 t70 65.67 86.59 0.13 Allowed 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.395 0.616 . . . . 0.0 110.093 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.55 HG21 ' HG3' ' A' ' 146' ' ' PRO . 1.4 mp -77.59 143.19 13.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.567 -0.742 . . . . 0.0 111.424 -172.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.507 ' O ' ' HB2' ' B' ' 477' ' ' SER . 10.2 t70 -90.94 -60.45 1.91 Allowed 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 171.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 37.7 m -157.31 110.36 1.87 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.094 -178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.55 ' HG3' HG21 ' A' ' 143' ' ' ILE . 2.6 Cg_exo -75.61 163.37 34.1 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.543 2.162 . . . . 0.0 111.829 176.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -114.78 154.23 28.93 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.472 -178.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.807 HG11 HD21 ' B' ' 483' ' ' ASN . 3.7 p -112.17 135.61 50.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.365 178.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -101.15 133.65 45.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.155 178.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.429 ' HB2' HG13 ' A' ' 179' ' ' VAL . 64.7 mt -114.82 3.31 14.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.65 0.738 . . . . 0.0 110.117 -178.106 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -79.82 -28.76 40.14 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.43 -0.804 . . . . 0.0 108.956 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.431 ' HG3' ' N ' ' A' ' 153' ' ' LEU . 3.7 pt20 -59.13 -32.05 69.5 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.475 175.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.566 HD11 HD21 ' B' ' 504' ' ' LEU . 69.3 mt -69.23 166.83 17.57 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.399 0.619 . . . . 0.0 112.186 -172.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -73.57 163.95 27.32 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.406 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 26.2 t -70.43 -44.8 76.93 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 CA-C-O 121.278 0.561 . . . . 0.0 109.842 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -64.83 -31.3 72.47 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.562 -0.744 . . . . 0.0 111.165 -178.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 55.4 m -60.55 -45.73 92.78 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.17 0.51 . . . . 0.0 110.797 177.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 182' ' ' VAL . 87.4 mt -68.91 -38.56 79.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.791 -178.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 -63.05 -40.39 97.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.512 176.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 12.2 ttt85 -64.08 -41.58 97.27 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.272 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.6 t80 -54.02 -52.29 61.27 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.762 173.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.637 ' HZ2' HG21 ' A' ' 181' ' ' ILE . 22.5 mtpp -67.19 -28.13 67.83 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.763 -0.653 . . . . 0.0 112.207 -175.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.4 tpp180 -78.22 -42.57 30.91 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.681 0.277 . . . . 0.0 111.148 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.7 m80 -77.43 -36.78 52.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.687 -177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.499 ' CE1' HG22 ' B' ' 490' ' ' ILE . 43.7 m-85 -83.72 -4.21 58.42 Favored 'General case' 0 C--N 1.33 -0.27 0 C-N-CA 121.149 -0.22 . . . . 0.0 111.337 178.257 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 59.03 78.77 0.25 Allowed 'General case' 0 C--O 1.234 0.265 0 O-C-N 123.625 0.578 . . . . 0.0 111.174 178.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.607 HD12 ' HG2' ' A' ' 162' ' ' LYS . 92.5 mt -115.71 113.19 42.58 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.06 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 15.9 Cg_exo -68.07 135.92 36.27 Favored 'Trans proline' 0 C--O 1.233 0.235 0 C-N-CA 123.647 2.898 . . . . 0.0 112.057 -177.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.422 ' CG2' HD11 ' A' ' 173' ' ' LEU . 3.7 t -171.04 159.73 6.17 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.652 -177.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 13.6 ptp180 -67.79 156.63 88.75 Favored Pre-proline 0 C--N 1.325 -0.492 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.543 176.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -77.32 154.59 32.15 Favored 'Trans proline' 0 C--O 1.236 0.387 0 C-N-CA 122.723 2.282 . . . . 0.0 112.407 176.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 85.36 50.4 4.06 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.258 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.422 HD11 ' CG2' ' A' ' 169' ' ' THR . 86.5 mt -94.03 145.38 24.7 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.854 0.359 . . . . 0.0 110.56 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.443 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 88.4 m-20 -113.59 178.03 4.42 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.256 178.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.696 ' O ' HG23 ' A' ' 179' ' ' VAL . 55.4 tptt -46.05 -57.91 4.05 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.879 0.737 . . . . 0.0 112.166 -177.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . 0.556 ' O ' ' HG2' ' A' ' 180' ' ' GLU . . . -54.52 -49.63 69.76 Favored 'General case' 0 N--CA 1.464 0.237 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -176.069 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -59.1 -43.02 91.84 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.017 0.437 . . . . 0.0 110.594 -177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 94.8 mt -61.81 -48.85 78.74 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.427 -0.806 . . . . 0.0 111.022 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 175' ' ' LYS . 13.6 t -58.66 -42.6 85.49 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.175 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.501 -177.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.556 ' HG2' ' O ' ' A' ' 176' ' ' ALA . 19.3 mm-40 -58.28 -49.74 76.07 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.651 178.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.637 HG21 ' HZ2' ' A' ' 162' ' ' LYS . 79.6 mt -65.4 -48.48 82.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.068 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.58 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.1 t -59.28 -45.76 92.88 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.436 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.959 -177.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.16 -39.91 94.74 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.374 -178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.4 t -59.22 -40.49 86.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.755 0.312 . . . . 0.0 110.726 179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -87.25 -26.43 23.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.776 0.322 . . . . 0.0 111.089 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.58 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 27.4 t80 -60.9 -44.02 97.7 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 123.008 0.523 . . . . 0.0 111.136 -177.044 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -79.94 21.64 0.55 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.06 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 45.5 m -145.77 28.75 1.14 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.816 178.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.642 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 73.2 mt -90.1 125.38 60.6 Favored Pre-proline 0 C--N 1.327 -0.41 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.666 178.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -67.47 140.3 51.97 Favored 'Trans proline' 0 C--O 1.234 0.309 0 C-N-CA 122.837 2.358 . . . . 0.0 110.973 172.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.614 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.0 p -153.05 134.74 5.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.16 0.505 . . . . 0.0 110.925 -174.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -102.78 109.17 20.66 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.406 -0.591 . . . . 0.0 109.406 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.599 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 40.1 tt0 -47.89 -62.56 1.4 Allowed 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -169.05 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -65.37 -45.13 85.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.504 0.192 . . . . 0.0 111.494 -174.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -61.68 -43.26 99.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.601 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 89.7 m -65.2 -37.16 86.44 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.039 -179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 22.1 mt -60.99 -47.27 87.23 Favored 'General case' 0 CA--C 1.52 -0.197 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 174.271 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.4 m -59.17 -46.06 89.39 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.354 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 69.3 m -61.15 -51.22 69.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.346 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.599 ' CD1' HD22 ' B' ' 488' ' ' LEU . 45.8 t80 -56.24 -55.99 26.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.291 -178.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.599 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 74.9 mt -55.72 -48.86 77.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.312 -178.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 2.9 t80 -62.21 -42.07 98.96 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.845 -177.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 52.4 m -62.95 -42.77 99.92 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.414 -178.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 200' ' ' PHE . 56.6 t -68.84 -28.09 38.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.04 0.448 . . . . 0.0 110.736 -179.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.599 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 14.2 mmm-85 -72.92 -18.05 61.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.538 175.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -92.89 -45.22 8.08 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.83 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -164.27 168.77 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.238 -0.652 . . . . 0.0 109.238 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.447 ' O ' ' HB2' ' B' ' 498' ' ' ARG . 13.3 mptt -91.42 -10.49 40.83 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.724 178.508 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -163.26 151.51 13.76 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.919 176.372 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.431 ' HA ' ' HG3' ' B' ' 494' ' ' GLU . 54.3 mtpt 51.43 46.17 26.9 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.501 177.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 15.6 m -52.09 109.23 0.35 Allowed 'General case' 0 C--N 1.33 -0.275 0 O-C-N 123.583 0.552 . . . . 0.0 110.957 -178.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -75.05 130.55 39.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.389 -175.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 32.1 tp -150.47 -43.03 0.13 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.194 -177.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 22.5 pttm -170.48 170.22 7.03 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.027 177.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -85.43 -65.12 1.05 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.879 0.371 . . . . 0.0 110.658 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 20.9 t0 -163.45 142.8 8.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.838 -0.619 . . . . 0.0 109.968 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 12.0 p -145.7 17.94 1.47 Allowed 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.165 -178.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 105.16 -111.46 3.74 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.829 177.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 34.8 m -105.93 -9.85 10.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.64 0.257 . . . . 0.0 111.378 -177.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 . . . . . 0 C--O 1.243 0.712 0 CA-C-O 118.776 -0.631 . . . . 0.0 109.622 177.284 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.478 0.96 0 CA-C-O 120.636 0.255 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 6.3 p-10 -97.31 148.69 22.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.706 0.289 . . . . 0.0 110.379 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -131.69 117.81 19.14 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.13 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 17.3 m -86.55 131.73 34.09 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.936 -175.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -65.6 -38.21 88.82 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.31 0.576 . . . . 0.0 109.752 174.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -136.42 112.5 9.7 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.405 177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -104.19 -126.12 5.75 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.691 -0.766 . . . . 0.0 111.467 176.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . 0.41 ' HB ' ' OG ' ' B' ' 465' ' ' SER . 47.9 t -84.92 -34.84 9.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-O 120.92 0.39 . . . . 0.0 109.997 177.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 119.63 -122.78 5.41 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.595 178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . 0.428 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.0 OUTLIER -75.04 -26.33 59.37 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.807 0.337 . . . . 0.0 111.707 -176.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.48 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.1 mp0 -63.33 -40.84 98.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.127 177.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . 0.41 ' OG ' ' HB ' ' B' ' 461' ' ' VAL . 12.1 m -68.06 -29.84 68.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.229 176.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' B' ' 463' ' ' THR . 54.4 tp -64.91 -46.22 82.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.745 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.503 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.8 t80 -52.59 -58.88 5.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.61 175.194 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.549 ' HE2' HD11 ' A' ' 201' ' ' ILE . 59.3 m-85 -62.62 -32.07 73.02 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 -175.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.76 -45.27 90.58 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.032 0.444 . . . . 0.0 110.393 176.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -63.39 -43.44 97.59 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.421 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 467' ' ' PHE . 77.0 t -57.63 -43.72 84.0 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-O 121.068 0.461 . . . . 0.0 110.444 177.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.0 mmt180 -56.74 -50.9 70.85 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.552 178.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -77.29 -24.59 50.93 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.607 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -78.45 -42.1 30.89 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 111.715 0.265 . . . . 0.0 111.715 -178.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 46.7 mt -78.71 -44.94 22.36 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.991 -0.284 . . . . 0.0 110.998 -177.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 70.06 -55.49 0.6 Allowed 'General case' 0 N--CA 1.47 0.563 0 O-C-N 123.912 0.757 . . . . 0.0 111.927 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.507 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 8.8 t -63.74 125.97 26.06 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.438 -179.09 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.62 -46.16 84.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.312 179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -64.72 -31.27 72.41 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.838 0.351 . . . . 0.0 110.36 -178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.507 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.86 -41.87 64.28 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.988 0.423 . . . . 0.0 110.942 178.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -69.54 -37.54 77.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.246 0.546 . . . . 0.0 109.748 177.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.686 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 28.8 tt0 -64.29 -38.57 91.51 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.405 175.5 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.807 HD21 HG11 ' A' ' 148' ' ' VAL . 25.4 t-20 -58.03 -44.57 87.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.873 176.531 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -55.98 -45.79 78.85 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.166 174.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.614 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.7 mt -67.79 -29.13 68.24 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.227 179.446 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.686 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -62.99 -43.19 99.47 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 120.918 0.389 . . . . 0.0 110.101 173.62 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 56.4 m -61.63 -35.82 78.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.266 176.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.599 HD22 ' CD1' ' A' ' 200' ' ' PHE . 25.0 mt -66.52 -52.08 49.72 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.265 179.376 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 11.2 m -61.06 -41.91 91.07 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -177.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.563 HD13 ' HE1' ' A' ' 186' ' ' PHE . 18.7 pt -69.7 -27.49 33.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.838 179.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -67.89 -39.1 83.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.192 0.52 . . . . 0.0 109.841 172.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . 0.554 HD21 ' HA ' ' A' ' 200' ' ' PHE . 14.8 m120 -72.48 -35.28 68.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.261 -177.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 95.7 mt-30 -87.06 18.65 3.47 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.528 -176.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . 0.431 ' HG3' ' HA ' ' A' ' 210' ' ' LYS . 13.7 tt0 56.26 49.11 15.89 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 121.162 0.506 . . . . 0.0 111.463 178.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.451 ' HB ' ' O ' ' B' ' 490' ' ' ILE . 75.7 t -103.43 -49.26 10.17 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.582 177.222 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.474 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 44.8 pt -112.24 172.16 3.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-O 120.917 0.389 . . . . 0.0 110.966 -179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.409 ' OG ' ' HG2' ' B' ' 500' ' ' GLU . 18.9 p -109.43 179.73 4.06 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.786 176.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.521 ' O ' HG23 ' B' ' 502' ' ' VAL . 57.9 ttp180 -59.85 -47.83 84.16 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.544 0.211 . . . . 0.0 110.775 -179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.32 -50.76 70.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.784 -179.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.474 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 5.4 mm-40 -56.36 -46.03 80.2 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.158 179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.408 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 63.6 tp -58.31 -48.62 79.95 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.43 -179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.546 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 67.1 t -65.65 -36.84 78.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.16 -177.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.402 HE21 ' HB2' ' B' ' 503' ' ' GLN . 16.2 mt-30 -77.04 -30.69 55.77 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -176.089 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.566 HD21 HD11 ' A' ' 153' ' ' LEU . 44.3 mt -66.73 -41.62 87.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.984 0.421 . . . . 0.0 111.78 -176.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -86.94 10.41 1.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.661 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.353 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.672 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 78.2 p -64.77 -44.2 72.18 Favored Pre-proline 0 CA--C 1.546 0.793 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -178.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.672 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 24.1 Cg_exo -67.46 -8.53 22.45 Favored 'Trans proline' 0 C--N 1.358 1.068 0 C-N-CA 122.086 1.858 . . . . 0.0 111.977 176.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 90.5 m-85 -99.92 -67.9 0.83 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.753 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.612 HD22 HD23 ' B' ' 515' ' ' LEU . 67.0 mt -96.22 -8.1 33.88 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.438 -173.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -64.68 -16.31 61.01 Favored Glycine 0 CA--C 1.518 0.237 0 C-N-CA 121.093 -0.575 . . . . 0.0 113.043 -176.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.592 ' HE3' ' O ' ' B' ' 507' ' ' PRO . 0.0 OUTLIER -87.76 -2.91 58.92 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.932 0.396 . . . . 0.0 110.518 178.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 66.4 m-85 -117.77 96.78 50.02 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-N 116.124 -0.489 . . . . 0.0 109.732 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_exo -52.52 -52.5 8.75 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.195 2.596 . . . . 0.0 112.879 -174.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -60.21 -39.82 87.93 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.905 0.383 . . . . 0.0 111.461 -177.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.612 HD23 HD22 ' B' ' 509' ' ' LEU . 25.4 tp -79.8 -44.1 21.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.957 -172.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.404 ' CD2' ' HE3' ' B' ' 520' ' ' LYS . 8.7 t80 -69.02 -32.98 72.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.284 -179.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -73.77 -35.37 64.96 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.125 178.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.48 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 11.5 t90 -56.38 -48.82 76.08 Favored 'General case' 0 N--CA 1.462 0.171 0 N-CA-C 109.038 -0.727 . . . . 0.0 109.038 173.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.546 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 21.6 t80 -55.92 -45.93 78.59 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.219 -0.901 . . . . 0.0 110.678 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.404 ' HE3' ' CD2' ' B' ' 516' ' ' PHE . 99.0 mttt -59.71 -47.93 83.7 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.107 177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -62.21 -41.92 98.83 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.429 -177.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 41.2 t80 -64.75 -35.54 81.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.052 0.453 . . . . 0.0 110.694 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 92.5 mt -87.48 -7.15 57.98 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.172 -179.613 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 68.41 26.82 74.09 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 121.032 -0.604 . . . . 0.0 111.969 -177.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 85.4 t80 -86.26 130.49 34.5 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.893 0.378 . . . . 0.0 110.531 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -128.27 147.09 50.58 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.382 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -107.98 12.34 27.08 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 121.204 0.526 . . . . 0.0 110.526 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 12.4 p . . . . . 0 C--O 1.25 1.099 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.54 -179.969 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . 0.725 ' HB3' ' HA2' ' A' ' 135' ' ' GLY . 16.0 m . . . . . 0 N--CA 1.474 0.767 0 CA-C-O 121.123 0.487 . . . . 0.0 110.639 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -123.26 -30.63 3.68 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.337 179.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.23 171.21 7.93 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.982 -0.553 . . . . 0.0 110.754 -178.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . 0.641 ' HA3' ' HA ' ' A' ' 134' ' ' ASP . . . -168.64 116.31 0.66 Allowed Glycine 0 N--CA 1.445 -0.748 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.737 177.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 56.5 m -61.94 -28.12 69.31 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.916 0.389 . . . . 0.0 111.348 -179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -131.31 -60.25 0.95 Allowed 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 175.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -119.03 131.71 56.0 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 171.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . 0.641 ' HA ' ' HA3' ' A' ' 130' ' ' GLY . 5.4 p-10 -69.41 134.6 49.2 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.152 0.501 . . . . 0.0 111.07 -176.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.725 ' HA2' ' HB3' ' A' ' 127' ' ' SER . . . 82.19 -8.32 61.23 Favored Glycine 0 C--O 1.226 -0.347 0 C-N-CA 120.961 -0.638 . . . . 0.0 113.121 177.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -144.46 38.69 1.28 Allowed Glycine 0 N--CA 1.449 -0.48 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.727 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -92.49 2.33 56.74 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.857 0.361 . . . . 0.0 110.962 -177.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 37.4 m -95.05 111.37 54.47 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.221 -179.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 5.1 Cg_exo -77.63 162.1 30.42 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.249 2.633 . . . . 0.0 111.606 176.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 58.3 t 61.57 91.34 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.093 0.473 . . . . 0.0 111.315 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.845 ' HG3' ' HD3' ' B' ' 476' ' ' ARG . 8.2 tt0 62.51 78.34 0.3 Allowed 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.953 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.4 p-10 -79.24 -11.62 59.95 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.409 -179.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 48.9 mt -113.03 144.9 19.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 176.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' B' ' 477' ' ' SER . 18.5 t70 -104.93 -60.63 1.58 Allowed 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 173.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 97.9 m -164.28 108.63 0.89 Allowed Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.776 177.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -64.17 143.03 82.76 Favored 'Trans proline' 0 N--CA 1.461 -0.439 0 C-N-CA 122.241 1.96 . . . . 0.0 111.748 176.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -98.66 118.99 36.62 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.148 -177.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.0 p -81.97 123.66 38.32 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-O 121.304 0.574 . . . . 0.0 110.792 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -89.39 131.26 35.54 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.177 176.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.465 ' HB2' HG13 ' A' ' 179' ' ' VAL . 96.8 mt -111.21 6.38 20.61 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.242 0.544 . . . . 0.0 110.842 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 54.9 t80 -81.66 -26.73 34.51 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 177.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.559 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 28.0 pt20 -67.79 -22.51 65.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.578 175.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.628 HD21 HD21 ' B' ' 504' ' ' LEU . 30.8 mt -67.26 151.14 48.04 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . 0.488 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 50.9 mt-30 -63.83 148.46 49.26 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.528 HG12 ' HE ' ' A' ' 159' ' ' ARG . 48.3 t -56.96 -46.85 84.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.199 0.523 . . . . 0.0 109.892 178.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -62.17 -33.42 74.49 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.318 -0.856 . . . . 0.0 111.606 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.783 HG21 ' HG2' ' B' ' 500' ' ' GLU . 25.8 m -64.42 -45.67 86.56 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.066 0.46 . . . . 0.0 110.897 179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.6 mt -64.25 -37.32 87.05 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-O 121.356 0.598 . . . . 0.0 110.519 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.528 ' HE ' HG12 ' A' ' 155' ' ' VAL . 74.2 mtt-85 -67.68 -38.13 83.29 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.53 176.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.569 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 36.6 ttm180 -65.2 -42.88 93.09 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.061 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.432 ' OH ' HD11 ' A' ' 189' ' ' ILE . 58.0 t80 -53.3 -47.81 68.91 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.916 173.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.644 ' NZ ' ' HB ' ' A' ' 181' ' ' ILE . 43.6 mttp -61.33 -49.43 77.03 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.823 178.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -63.79 -48.1 78.24 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.208 -177.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 13.0 t60 -65.66 -41.77 92.14 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.585 -0.28 . . . . 0.0 110.91 -176.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 60.4 m-85 -87.0 3.22 46.8 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.999 -0.28 . . . . 0.0 111.666 -178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt 55.74 60.58 3.22 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.043 178.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.445 HD12 ' HA ' ' A' ' 162' ' ' LYS . 85.9 mt -94.45 130.7 32.91 Favored Pre-proline 0 C--N 1.324 -0.527 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.957 -178.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -62.33 125.24 15.85 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.163 1.909 . . . . 0.0 111.423 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.402 HG21 ' HD3' ' A' ' 162' ' ' LYS . 3.2 p -150.81 -175.52 5.16 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.938 -177.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 16.7 ptp180 -132.3 147.05 64.16 Favored Pre-proline 0 C--N 1.326 -0.418 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -59.3 131.91 43.62 Favored 'Trans proline' 0 N--CA 1.463 -0.276 0 C-N-CA 122.345 2.03 . . . . 0.0 111.682 177.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 93.84 46.82 3.06 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.687 -0.768 . . . . 0.0 111.71 -177.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 90.9 mt -75.46 152.02 37.97 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.042 0.449 . . . . 0.0 111.151 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.501 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 6.2 m-20 -104.21 164.74 11.51 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.529 178.071 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.412 ' HE2' HG22 ' A' ' 155' ' ' VAL . 5.8 tmtt? -56.33 -50.08 72.51 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.667 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -64.52 -36.95 85.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.073 -179.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.427 ' HA ' ' HG2' ' A' ' 180' ' ' GLU . 10.2 mm-40 -61.63 -41.71 97.87 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 121.555 0.693 . . . . 0.0 110.249 177.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.602 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 98.7 mt -61.85 -52.06 65.69 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.883 177.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.465 HG13 ' HB2' ' A' ' 150' ' ' LEU . 78.5 t -58.24 -48.99 83.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 O-C-N 123.614 0.571 . . . . 0.0 111.626 -178.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.549 ' HG3' ' N ' ' A' ' 181' ' ' ILE . 6.7 pt-20 -62.02 -46.19 90.28 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.44 -175.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.644 ' HB ' ' NZ ' ' A' ' 162' ' ' LYS . 80.6 mt -70.95 -39.27 74.96 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 120.622 0.249 . . . . 0.0 110.916 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.533 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 54.6 t -64.66 -47.55 88.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 178.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.94 -41.16 98.77 Favored Glycine 0 N--CA 1.449 -0.482 0 O-C-N 123.454 0.471 . . . . 0.0 112.432 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 37.7 t -59.19 -45.14 91.86 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.891 0.377 . . . . 0.0 110.544 178.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.6 t-80 -78.27 -29.76 48.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.073 0.463 . . . . 0.0 110.594 179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.538 ' HE1' HD13 ' B' ' 490' ' ' ILE . 15.3 t80 -60.83 -39.02 87.48 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.683 -178.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.7 mtpp -75.78 6.6 4.77 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.969 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 p -128.88 21.09 5.9 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.922 0.392 . . . . 0.0 111.248 179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.726 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.3 mt -88.85 118.35 69.2 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.581 -0.282 . . . . 0.0 110.417 176.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . 0.447 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 5.3 Cg_exo -78.22 137.74 15.44 Favored 'Trans proline' 0 N--CA 1.461 -0.435 0 C-N-CA 123.003 2.469 . . . . 0.0 111.569 176.453 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.506 HG11 ' HB3' ' B' ' 485' ' ' LEU . 0.0 OUTLIER -124.77 167.18 19.18 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 CA-C-O 121.21 0.528 . . . . 0.0 111.786 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -125.28 110.38 13.95 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.945 -1.025 . . . . 0.0 108.684 174.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -48.36 -59.82 3.16 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 123.392 0.433 . . . . 0.0 111.766 -172.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.2 tttm -55.55 -57.37 12.2 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.68 179.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.6 m-20 -62.43 -48.37 79.99 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.602 -173.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.1 m -63.59 -41.14 98.38 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.541 -175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 68.8 mt -65.17 -43.22 92.42 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.792 -0.363 . . . . 0.0 110.193 176.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.1 m -59.26 -41.09 87.98 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.699 179.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 91.7 m -58.36 -55.99 27.84 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.908 176.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.524 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 60.6 t80 -57.53 -50.81 71.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.699 -0.682 . . . . 0.0 111.399 -177.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.482 HD11 ' HE2' ' B' ' 468' ' ' PHE . 63.9 mt -57.36 -55.13 22.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.766 -175.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.48 -32.74 70.39 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.0 m -70.45 -45.97 64.73 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.775 -0.37 . . . . 0.0 111.218 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 58.4 t -75.1 -27.96 20.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-O 120.974 0.416 . . . . 0.0 111.158 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 10.6 mtp180 -72.55 -8.91 57.56 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.188 177.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -106.42 -51.51 2.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.549 -0.296 . . . . 0.0 110.745 174.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -159.66 -64.72 0.07 Allowed 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.842 0.353 . . . . 0.0 110.951 179.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.642 ' HG3' ' H ' ' A' ' 209' ' ' ASN . 7.0 ptpp? -171.6 -65.35 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.747 -178.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . 0.642 ' H ' ' HG3' ' A' ' 208' ' ' LYS . 24.1 p30 -155.15 161.14 41.31 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -88.68 84.53 6.72 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.236 0.541 . . . . 0.0 110.502 -177.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 22.3 m -109.32 5.22 23.41 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.721 -179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -105.94 111.78 24.56 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.793 -178.593 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 92.0 mt -114.8 167.82 10.43 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.877 -0.601 . . . . 0.0 109.651 178.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -74.08 134.11 42.91 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.998 0.428 . . . . 0.0 111.165 -177.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -135.25 -45.85 0.7 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.475 178.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -91.76 115.76 28.32 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.864 179.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 13.7 p -156.44 138.3 14.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.443 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -130.89 75.94 0.42 Allowed Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.347 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 13.8 p -93.16 -25.19 5.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 120.491 0.186 . . . . 0.0 110.937 -177.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 49.6 t-80 . . . . . 0 C--O 1.251 1.144 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.895 -176.645 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 22.9 p . . . . . 0 N--CA 1.478 0.963 0 CA-C-O 120.636 0.255 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -107.34 -50.3 3.11 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.807 0.337 . . . . 0.0 110.591 -178.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -144.49 158.45 43.75 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.908 178.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 38.8 m -92.11 101.89 14.42 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.068 0.461 . . . . 0.0 110.622 179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -86.63 165.8 15.87 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.806 -0.633 . . . . 0.0 110.189 179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -71.59 -21.84 61.81 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.723 0.297 . . . . 0.0 110.384 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -77.97 93.73 1.19 Allowed Glycine 0 N--CA 1.445 -0.737 0 C-N-CA 120.924 -0.655 . . . . 0.0 111.761 176.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 26.8 m -106.36 -20.76 5.81 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.032 0.444 . . . . 0.0 110.25 176.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -122.67 26.54 6.22 Favored Glycine 0 N--CA 1.444 -0.775 0 N-CA-C 111.231 -0.748 . . . . 0.0 111.231 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.25 -38.0 85.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.469 -0.366 . . . . 0.0 111.497 -178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.466 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 1.6 mp0 -58.56 -43.77 89.47 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.598 178.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 6.8 m -59.29 -44.07 92.52 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.028 0.442 . . . . 0.0 110.441 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.4 tt -60.08 -49.83 76.09 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.815 178.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.513 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.4 t80 -53.03 -55.87 20.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.6 176.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.524 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 29.9 m-85 -63.92 -34.25 77.54 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -174.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -65.42 -43.65 89.86 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.542 -0.463 . . . . 0.0 109.985 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -62.56 -45.28 93.64 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.928 175.786 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.513 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -57.31 -49.41 80.07 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-O 120.987 0.422 . . . . 0.0 110.383 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 41.4 ttm180 -62.68 -38.41 90.25 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.838 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 14.7 tptp -80.35 -33.01 37.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.521 -174.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -80.56 -46.25 16.06 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.703 -0.226 . . . . 0.0 111.319 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.5 mp -59.1 -46.66 87.73 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.7 178.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.845 ' HD3' ' HG3' ' A' ' 141' ' ' GLN . 51.1 mtt85 71.55 -49.24 0.68 Allowed 'General case' 0 N--CA 1.473 0.719 0 O-C-N 123.74 0.65 . . . . 0.0 112.705 173.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.476 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.0 t -66.21 129.45 39.86 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 120.955 0.407 . . . . 0.0 110.711 -178.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -54.67 -49.34 70.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.727 -178.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -75.55 -22.5 56.99 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 120.622 -0.431 . . . . 0.0 110.835 -177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -66.28 -51.41 57.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.133 0.492 . . . . 0.0 110.117 176.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.486 ' CE2' HD11 ' B' ' 485' ' ' LEU . 90.5 t80 -63.37 -40.64 97.8 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.945 176.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.572 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 38.1 tt0 -60.76 -42.78 98.11 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.758 -0.655 . . . . 0.0 109.865 177.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.418 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 6.9 t30 -59.38 -39.9 84.79 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 -179.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -56.6 -45.95 81.15 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.389 0.614 . . . . 0.0 109.915 172.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.506 ' HB3' HG11 ' A' ' 191' ' ' VAL . 83.5 mt -67.02 -33.19 75.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.362 179.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.726 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.0 OUTLIER -57.75 -45.79 85.41 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.224 0.535 . . . . 0.0 109.867 174.132 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 36.4 m -59.69 -38.93 82.9 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.401 176.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.413 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.9 mt -65.34 -49.31 69.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.62 -179.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 10.8 m -63.76 -42.89 97.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.665 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.538 HD13 ' HE1' ' A' ' 186' ' ' PHE . 26.5 pt -69.89 -28.53 37.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.874 179.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 67.9 t80 -67.61 -43.05 81.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.172 0.511 . . . . 0.0 110.344 174.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -79.49 -16.21 56.43 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.791 -176.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.8 mt-30 -98.64 21.26 11.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.361 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 65.84 25.74 11.23 Favored 'General case' 0 N--CA 1.468 0.452 0 O-C-N 123.404 0.44 . . . . 0.0 112.103 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.569 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 89.2 t -92.25 -56.19 5.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.755 0.312 . . . . 0.0 110.663 178.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.459 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 32.8 pt -111.04 162.48 8.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 120.726 0.298 . . . . 0.0 110.289 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 8.9 t -105.82 -175.24 2.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.488 -0.324 . . . . 0.0 110.13 179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.543 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.3 ttm180 -55.85 -51.65 66.77 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.677 -178.588 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . 0.428 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -50.46 -50.81 51.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.892 -179.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.783 ' HG2' HG21 ' A' ' 157' ' ' THR . 3.8 mp0 -60.47 -45.17 94.7 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.736 0.303 . . . . 0.0 110.939 179.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.615 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 64.9 tp -57.32 -46.0 83.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.029 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.784 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 54.5 t -64.54 -38.01 81.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.954 -179.759 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.559 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 48.6 mt-30 -71.37 -42.48 68.38 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.912 -177.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.628 HD21 HD21 ' A' ' 153' ' ' LEU . 76.5 mt -63.33 -40.86 98.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -174.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.603 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.7 p -86.63 4.49 3.82 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-O 120.982 0.42 . . . . 0.0 111.262 -177.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.457 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 24.0 t -59.0 -52.44 74.77 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.751 -179.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.457 ' HD2' ' N ' ' B' ' 506' ' ' SER . 10.8 Cg_endo -57.75 -18.35 33.5 Favored 'Trans proline' 0 C--N 1.357 0.993 0 C-N-CA 122.082 1.854 . . . . 0.0 113.154 176.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -90.71 -52.0 5.1 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.137 -176.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.603 ' HG ' HG22 ' B' ' 505' ' ' VAL . 62.4 mt -97.71 -11.72 23.14 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.536 -174.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.56 -14.04 64.14 Favored Glycine 0 C--O 1.23 -0.136 0 C-N-CA 121.391 -0.433 . . . . 0.0 112.875 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 53.1 mttm -77.22 -15.51 59.45 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.271 0.557 . . . . 0.0 109.659 176.374 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -124.08 96.89 41.55 Favored Pre-proline 0 N--CA 1.452 -0.371 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.247 -176.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -49.58 -48.3 19.56 Favored 'Trans proline' 0 CA--C 1.529 0.253 0 C-N-CA 123.234 2.622 . . . . 0.0 113.504 -176.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -66.94 -40.6 87.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.985 0.421 . . . . 0.0 111.088 -177.32 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 18.5 tp -69.23 -44.84 71.2 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.523 -175.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -68.31 -32.88 73.33 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.087 178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 35.1 t-20 -63.5 -43.0 98.48 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.466 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 12.4 t90 -57.28 -49.06 77.26 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.846 177.694 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.784 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 66.9 t80 -59.04 -46.72 87.52 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.145 -178.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 57.2 mtpt -64.17 -36.25 83.46 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.968 179.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -72.01 -37.42 69.79 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.108 -178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -66.87 -34.35 77.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.28 0.562 . . . . 0.0 110.583 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.484 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 9.0 mp -83.93 -14.65 50.44 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.038 -179.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.97 35.82 61.2 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.435 -0.888 . . . . 0.0 111.139 -174.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -77.5 114.84 16.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.253 -0.473 . . . . 0.0 110.468 -177.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -100.16 147.04 26.12 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.967 178.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -107.17 75.95 1.06 Allowed 'General case' 0 C--N 1.321 -0.67 0 CA-C-O 121.4 0.619 . . . . 0.0 110.786 -178.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 34.5 t . . . . . 0 C--O 1.251 1.174 0 CA-C-N 115.265 -0.879 . . . . 0.0 108.881 177.021 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.476 0.833 0 CA-C-O 120.667 0.27 . . . . 0.0 110.714 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 80.1 m-20 -82.8 160.28 22.28 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 120.816 0.341 . . . . 0.0 110.694 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -90.54 120.69 31.84 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.041 -179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -140.32 175.61 21.87 Favored Glycine 0 N--CA 1.446 -0.679 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 178.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 7.5 t -134.82 104.24 5.93 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-O 121.198 0.523 . . . . 0.0 110.187 178.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -155.76 159.41 39.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.507 -0.77 . . . . 0.0 109.211 179.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -136.63 -45.02 0.6 Allowed 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.728 -0.389 . . . . 0.0 111.071 179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -74.84 157.66 34.74 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.368 178.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 164.9 149.71 5.92 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.842 -0.694 . . . . 0.0 111.921 -178.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 69.24 24.15 76.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.292 -179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -92.37 148.68 21.93 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 110.349 -0.241 . . . . 0.0 110.349 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.427 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 27.3 t -76.0 112.69 21.73 Favored Pre-proline 0 C--N 1.322 -0.615 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 175.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 6.8 Cg_exo -74.22 -17.59 21.55 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.956 2.437 . . . . 0.0 112.519 -176.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 18.3 m -126.12 164.87 25.13 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.562 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.177 -179.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 33.3 tt0 -164.81 95.77 0.71 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.165 176.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -102.48 -34.62 9.07 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 -179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 37.6 mt 71.8 136.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.202 0 CA-C-N 114.631 -1.168 . . . . 0.0 111.634 178.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -93.7 -68.17 0.82 Allowed 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.188 -0.915 . . . . 0.0 109.028 176.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 58.9 m -154.89 114.08 2.37 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.432 -179.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -57.91 133.26 54.74 Favored 'Trans proline' 0 N--CA 1.461 -0.403 0 C-N-CA 122.367 2.044 . . . . 0.0 111.296 175.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -72.42 110.09 6.58 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.302 -176.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -73.7 110.36 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 172.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.589 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 18.9 t0 -72.38 88.15 1.18 Allowed 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 178.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.555 HD23 HD22 ' B' ' 504' ' ' LEU . 95.7 mt -89.57 -8.06 53.49 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.818 -176.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 37.8 t80 -82.69 -23.06 34.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.865 -178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.589 ' NE2' ' HB3' ' A' ' 149' ' ' ASP . 27.5 pt20 -74.2 -18.94 60.69 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.86 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.458 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.3 mt -65.79 155.27 36.71 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.742 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -71.26 158.93 35.53 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.159 179.229 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.411 HG13 ' CD1' ' A' ' 178' ' ' LEU . 16.6 t -60.67 -46.32 96.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 109.972 -179.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 159' ' ' ARG . 84.7 m-20 -67.71 -21.34 65.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.733 -179.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 33.3 m -69.5 -51.32 36.89 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.183 0.516 . . . . 0.0 110.468 177.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 30.7 mt -65.96 -32.58 74.16 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 122.034 0.921 . . . . 0.0 109.57 176.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.545 ' HB3' ' HA ' ' A' ' 156' ' ' ASN . 77.8 ttt180 -63.08 -43.37 98.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 114.309 -1.314 . . . . 0.0 110.185 175.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.581 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 17.8 ttm180 -69.5 -37.73 77.31 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.543 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.463 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 70.9 t80 -51.53 -57.37 9.25 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-O 120.605 0.24 . . . . 0.0 110.7 174.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.68 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 7.1 ptpp? -66.96 -27.02 67.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.794 0.33 . . . . 0.0 111.13 -178.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 tpt180 -69.43 -47.95 62.47 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.777 179.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -71.93 -45.44 61.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.042 -177.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.431 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 70.8 m-85 -81.74 1.91 32.28 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.331 -177.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 57.4 74.47 0.42 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.25 176.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.68 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 90.0 mt -111.45 106.86 57.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.944 177.734 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.473 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -58.63 126.02 20.04 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.305 2.003 . . . . 0.0 111.39 179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.65 ' HB ' HD11 ' A' ' 173' ' ' LEU . 3.1 p -133.35 165.36 25.01 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.125 -176.173 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -107.28 140.91 21.93 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_exo -56.66 137.24 80.22 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.755 2.303 . . . . 0.0 112.488 -179.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 99.9 42.47 2.64 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.337 179.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.65 HD11 ' HB ' ' A' ' 169' ' ' THR . 95.8 mt -85.93 145.67 27.04 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.019 0.438 . . . . 0.0 110.95 -179.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.654 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 18.0 m120 -102.04 169.59 8.66 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.999 177.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.526 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.5 tptm -59.87 -54.24 48.5 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.317 -178.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -60.79 -33.39 72.91 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.982 0.42 . . . . 0.0 110.66 -179.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.654 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 15.6 mm100 -62.0 -45.06 95.28 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.304 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.619 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 62.7 mt -59.14 -47.49 85.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.518 178.69 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 175' ' ' LYS . 18.3 t -59.29 -45.05 93.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.072 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -61.64 -46.13 91.09 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.17 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 86.8 mt -58.49 -45.84 89.92 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 CA-C-O 121.165 0.507 . . . . 0.0 110.426 177.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.569 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 70.3 t -62.22 -48.63 87.52 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.991 -179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -65.02 -38.89 95.97 Favored Glycine 0 N--CA 1.453 -0.188 0 C-N-CA 121.178 -0.534 . . . . 0.0 112.384 -178.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 48.2 t -59.03 -43.29 91.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.801 0.334 . . . . 0.0 110.811 178.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -84.47 -23.23 29.99 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.0 0.429 . . . . 0.0 110.951 179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.569 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 20.7 t80 -64.41 -41.62 96.53 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.799 -177.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 81.2 mttt -70.62 -18.35 62.88 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.677 178.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 14.9 p -106.5 27.41 8.81 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 -176.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.636 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.9 mt -89.9 114.07 59.4 Favored Pre-proline 0 C--N 1.328 -0.366 0 CA-C-O 120.547 0.213 . . . . 0.0 110.448 175.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_endo -68.49 103.92 1.03 Allowed 'Trans proline' 0 N--CA 1.463 -0.321 0 C-N-CA 122.436 2.091 . . . . 0.0 111.663 177.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.63 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.9 p -110.47 156.85 11.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.361 -176.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -127.81 126.23 41.32 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.481 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.4 tt0 -50.9 -59.71 3.85 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.92 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -60.91 -57.16 13.83 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -173.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -67.62 -39.59 84.71 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 -171.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 95.6 m -67.58 -38.63 84.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.521 -0.308 . . . . 0.0 111.611 -178.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 39.6 mt -63.41 -46.11 87.9 Favored 'General case' 0 N--CA 1.462 0.156 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 174.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 32.6 m -59.09 -40.55 85.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.535 177.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 21.1 m -57.56 -55.79 30.33 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.248 177.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.552 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.5 t80 -62.09 -51.58 67.38 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.235 -175.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 68.2 mt -59.55 -48.88 85.71 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.78 -175.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 -71.43 -31.2 66.94 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.081 -174.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.5 m -72.7 -53.97 10.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.365 -0.38 . . . . 0.0 111.198 178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.518 HG11 HD23 ' B' ' 523' ' ' LEU . 54.4 t -65.29 -36.09 76.89 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 CA-C-O 120.689 0.28 . . . . 0.0 111.658 -174.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 11.7 mtp180 -72.33 -8.17 53.46 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.807 0.337 . . . . 0.0 111.079 177.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.441 HD22 ' HA ' ' A' ' 206' ' ' ASN . 0.9 OUTLIER -101.88 -52.85 3.08 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 179.128 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.425 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 9.4 t70 -166.6 -159.74 0.37 Allowed 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 107.901 -1.148 . . . . 0.0 107.901 176.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.539 ' HD3' ' O ' ' B' ' 523' ' ' LEU . 25.2 mtmm -135.34 131.89 36.97 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 121.95 -0.469 . . . . 0.0 111.07 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 10.6 m120 68.42 -76.34 0.06 Allowed 'General case' 0 N--CA 1.467 0.407 0 O-C-N 123.982 0.801 . . . . 0.0 110.688 -177.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 82.6 tttt 68.55 158.29 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.094 0.558 . . . . 0.0 111.422 176.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 16.5 t 67.29 32.85 5.72 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.731 0.776 . . . . 0.0 109.843 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -81.37 40.93 0.59 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.893 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 49.3 tp -71.91 134.82 46.25 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.501 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm 71.36 99.17 0.07 Allowed 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.992 0.807 . . . . 0.0 110.423 -178.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -78.48 -22.36 47.62 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.439 -175.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -80.85 140.01 35.63 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.991 0.424 . . . . 0.0 110.424 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 19.6 m -135.62 32.44 3.03 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.33 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -80.2 56.55 4.63 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.663 -178.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 26.8 m -103.2 176.72 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-O 120.823 0.344 . . . . 0.0 110.89 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 . . . . . 0 C--O 1.245 0.818 0 CA-C-O 118.587 -0.72 . . . . 0.0 109.85 -178.175 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 21.7 p . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 110.566 -0.161 . . . . 0.0 110.566 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 5.0 m-20 67.32 175.63 0.25 Allowed 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.21 0.604 . . . . 0.0 111.389 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -125.0 -32.11 3.06 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 120.731 0.301 . . . . 0.0 111.624 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 18.3 m -133.48 133.55 42.38 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.626 -178.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 50.1 tttm -76.79 145.9 38.22 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.613 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -122.37 -170.1 2.02 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.245 177.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 118.85 -132.08 9.48 Favored Glycine 0 N--CA 1.448 -0.51 0 C-N-CA 121.029 -0.605 . . . . 0.0 111.673 -179.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 39.7 t -90.92 84.44 2.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 121.311 0.577 . . . . 0.0 109.978 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -156.54 26.07 0.52 Allowed Glycine 0 N--CA 1.447 -0.601 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.124 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.6 t -76.86 -24.17 52.64 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 49.3 mp0 -64.16 -47.91 78.05 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.663 175.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 12.2 m -60.77 -35.11 75.61 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.241 177.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 35.9 tp -63.08 -52.33 63.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.153 176.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.506 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.8 t80 -52.54 -57.89 8.53 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 115.714 -0.675 . . . . 0.0 111.95 177.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.401 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.8 m-85 -64.39 -34.53 78.38 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -173.089 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.4 -40.63 96.17 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.252 175.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.1 mttt -68.27 -34.92 77.06 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.696 177.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.506 HG23 ' O ' ' B' ' 467' ' ' PHE . 98.4 t -63.1 -42.92 98.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 121.075 0.464 . . . . 0.0 110.073 175.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.27 -43.24 92.51 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.441 178.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -74.35 -36.55 63.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.185 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.574 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -66.6 -48.95 67.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.69 -177.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . 0.435 HD23 ' O ' ' B' ' 480' ' ' ALA . 10.3 mp -71.43 -37.15 71.47 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.026 178.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.4 ttt85 71.89 -60.83 0.51 Allowed 'General case' 0 N--CA 1.467 0.384 0 O-C-N 124.134 0.896 . . . . 0.0 112.642 170.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 45.4 m -67.51 139.45 56.99 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.945 -177.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -58.03 -44.72 87.51 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.06 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -65.12 -39.11 92.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.557 179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.435 ' O ' HD23 ' B' ' 475' ' ' LEU . . . -62.09 -51.57 67.4 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.871 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -65.84 -36.94 84.86 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.215 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.684 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 30.3 tt0 -59.44 -42.13 91.2 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 175.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.65 ' HA ' ' NH1' ' B' ' 486' ' ' ARG . 5.1 t30 -60.8 -43.29 98.34 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.98 -179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -53.8 -45.19 70.7 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 121.325 0.583 . . . . 0.0 110.359 172.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.63 ' HB3' HG21 ' A' ' 191' ' ' VAL . 86.2 mt -67.53 -31.81 72.16 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.466 -179.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.684 ' HD3' ' O ' ' B' ' 482' ' ' GLU . 0.0 OUTLIER -63.39 -36.91 85.28 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 173.218 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.1 m -65.14 -36.2 83.5 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.187 -0.461 . . . . 0.0 109.897 177.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.552 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.3 mt -65.25 -48.55 72.86 Favored 'General case' 0 N--CA 1.454 -0.262 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.337 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 13.9 m -65.04 -42.26 94.13 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.828 -177.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.52 HD13 ' HE1' ' A' ' 186' ' ' PHE . 38.7 pt -69.15 -30.74 47.41 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.178 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.169 -179.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 60.3 t80 -68.37 -45.01 73.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.111 0.481 . . . . 0.0 110.242 173.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -62.24 -38.8 90.61 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.991 -177.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -86.31 16.28 4.58 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.698 -176.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . 0.427 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 0.1 OUTLIER 63.08 38.95 10.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.985 0.421 . . . . 0.0 111.045 174.926 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.581 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.9 t -96.7 -33.71 4.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.255 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 39.0 pt -124.73 153.32 31.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.929 0.395 . . . . 0.0 111.212 -179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 46.2 m -80.02 166.23 21.77 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.019 178.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.524 ' O ' HG23 ' B' ' 502' ' ' VAL . 20.7 ttm180 -54.92 -53.98 48.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.765 178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.19 -46.56 85.56 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.823 -179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.554 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.0 mm-40 -55.48 -46.29 76.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.943 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 55.2 tp -59.67 -51.12 71.14 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.038 0.447 . . . . 0.0 110.99 177.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.524 HG23 ' O ' ' B' ' 498' ' ' ARG . 59.9 t -60.09 -35.44 61.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.667 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -67.42 -42.25 83.5 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.91 178.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.555 HD22 HD23 ' A' ' 150' ' ' LEU . 93.8 mt -66.77 -39.91 88.03 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.78 0.324 . . . . 0.0 111.508 -175.532 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.431 HG11 ' CE2' ' B' ' 519' ' ' PHE . 4.6 p -85.14 2.43 4.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.035 -176.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.704 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 14.2 t -58.49 -53.84 62.1 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.357 179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 31.8 Cg_exo -61.83 -26.66 79.57 Favored 'Trans proline' 0 C--N 1.354 0.841 0 C-N-CA 121.744 1.629 . . . . 0.0 112.143 176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -73.93 -60.59 2.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.575 -177.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.575 HD22 HD23 ' B' ' 515' ' ' LEU . 78.8 mt -102.28 -10.39 19.56 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.817 0.303 . . . . 0.0 111.817 -172.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.21 -21.76 64.43 Favored Glycine 0 C--O 1.229 -0.166 0 C-N-CA 121.229 -0.51 . . . . 0.0 113.312 -176.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 21.0 pttm -81.98 0.95 37.79 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.079 0.466 . . . . 0.0 110.79 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.574 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 50.2 m-85 -125.58 90.29 50.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 174.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -48.78 -45.7 27.22 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.484 2.79 . . . . 0.0 113.602 -174.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -68.29 -45.23 73.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.975 0.417 . . . . 0.0 110.659 -178.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.575 HD23 HD22 ' B' ' 509' ' ' LEU . 15.5 tp -67.89 -43.13 80.02 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.635 -175.219 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.461 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 25.8 t80 -67.29 -38.84 85.68 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.446 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -66.69 -37.78 85.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.562 -0.29 . . . . 0.0 110.491 178.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.7 t90 -56.61 -49.3 75.35 Favored 'General case' 0 N--CA 1.462 0.148 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 175.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.431 ' CE2' HG11 ' B' ' 505' ' ' VAL . 66.0 t80 -58.86 -45.9 89.02 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.859 179.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.429 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 58.3 mtpt -62.95 -42.71 99.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.874 179.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . 0.409 HD22 ' C ' ' B' ' 521' ' ' ASN . 0.2 OUTLIER -66.44 -35.5 80.46 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.988 179.943 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 42.8 t80 -65.21 -42.72 93.22 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.346 179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.539 ' O ' ' HD3' ' A' ' 208' ' ' LYS . 81.8 mt -78.21 -14.96 59.24 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.374 -179.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 78.15 15.98 80.33 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.625 -0.798 . . . . 0.0 111.345 -176.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 61.2 t80 -85.69 104.99 15.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -92.64 105.96 18.02 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.655 -177.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -142.32 68.24 1.32 Allowed 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 C--O 1.251 1.176 0 CA-C-O 118.152 -0.928 . . . . 0.0 110.08 -175.052 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 110.19 -0.3 . . . . 0.0 110.19 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -59.6 -55.95 28.03 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.965 0.412 . . . . 0.0 110.941 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -140.42 -163.58 1.55 Allowed 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.285 -176.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -62.24 -33.13 85.02 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 121.171 -0.538 . . . . 0.0 111.894 177.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 16.4 m -67.87 103.61 1.5 Allowed 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -67.14 160.46 26.76 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.538 -178.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -77.66 -4.22 44.95 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.083 -174.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 16.5 t70 60.11 86.07 0.1 Allowed 'General case' 0 N--CA 1.463 0.221 0 O-C-N 123.773 0.671 . . . . 0.0 110.646 -177.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -165.31 101.42 0.18 Allowed Glycine 0 N--CA 1.446 -0.661 0 C-N-CA 120.835 -0.698 . . . . 0.0 111.884 -178.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -124.23 26.95 5.69 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 121.084 -0.579 . . . . 0.0 111.862 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -81.02 -47.0 14.18 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.17 0.509 . . . . 0.0 110.376 -179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.1 p -160.77 141.79 8.78 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.749 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -75.9 173.91 13.69 Favored 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 122.426 2.084 . . . . 0.0 111.959 177.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 16.0 m -93.7 35.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.242 -176.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 54.4 68.19 0.9 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.507 -177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -81.59 -3.19 52.66 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.982 -177.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.428 HG21 ' HG3' ' A' ' 146' ' ' PRO . 16.7 mt -73.52 137.56 23.05 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.479 -178.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -98.36 -57.9 2.09 Favored 'General case' 0 C--N 1.315 -0.901 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 175.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 53.3 m -163.3 113.08 1.02 Allowed Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 114.855 -1.066 . . . . 0.0 109.459 177.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.428 ' HG3' HG21 ' A' ' 143' ' ' ILE . 3.5 Cg_exo -73.72 155.63 49.17 Favored 'Trans proline' 0 N--CA 1.46 -0.448 0 C-N-CA 122.534 2.156 . . . . 0.0 111.159 177.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -123.02 145.93 48.09 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.772 0.32 . . . . 0.0 111.256 -176.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.1 p -97.87 125.23 51.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.523 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.91 176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.438 ' HB2' ' OE1' ' A' ' 152' ' ' GLN . 11.0 m-20 -72.96 -30.49 63.88 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.188 0.518 . . . . 0.0 111.687 -174.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.439 HD23 HD22 ' B' ' 504' ' ' LEU . 64.8 mt 60.5 7.16 1.26 Allowed 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 114.794 -1.094 . . . . 0.0 112.114 -176.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 2.2 t80 -75.14 -26.42 59.14 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.457 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.6 OUTLIER -61.59 -17.87 56.91 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 114.682 -1.145 . . . . 0.0 112.076 -177.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.591 ' O ' ' HB ' ' A' ' 157' ' ' THR . 28.1 mt -80.42 4.6 17.56 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . 0.673 ' HA ' HE21 ' A' ' 154' ' ' GLN . 0.0 OUTLIER 55.61 -170.79 0.07 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 -176.782 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.609 HG12 HD12 ' A' ' 178' ' ' LEU . 1.6 m -77.85 -37.64 23.85 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 O-C-N 121.632 -0.667 . . . . 0.0 110.776 172.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -58.21 -53.69 55.43 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 112.536 0.569 . . . . 0.0 112.536 -175.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.591 ' HB ' ' O ' ' A' ' 153' ' ' LEU . 41.9 m -70.57 -34.68 72.48 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.641 0.258 . . . . 0.0 111.388 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.442 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 82.8 mt -63.06 -40.18 96.92 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-O 121.351 0.596 . . . . 0.0 110.523 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.2 mtt180 -69.88 -31.4 69.21 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.815 177.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.548 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 29.4 ttm180 -68.27 -42.37 79.65 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.824 -0.436 . . . . 0.0 109.824 176.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 52.8 t80 -52.05 -51.25 58.72 Favored 'General case' 0 N--CA 1.456 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.409 173.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.451 ' NZ ' HG23 ' A' ' 182' ' ' VAL . 54.4 mttp -61.01 -43.65 98.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.745 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.6 ttt180 -70.38 -38.87 74.8 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.29 -175.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -79.53 -35.52 39.86 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -176.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.433 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 59.3 m-85 -92.75 1.69 57.14 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 111.396 0.147 . . . . 0.0 111.396 -179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt 59.34 79.89 0.21 Allowed 'General case' 0 C--O 1.234 0.245 0 O-C-N 123.804 0.69 . . . . 0.0 111.38 179.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.439 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 96.8 mt -120.17 100.37 47.93 Favored Pre-proline 0 C--N 1.323 -0.554 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.92 176.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.439 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 19.1 Cg_endo -61.59 125.65 17.23 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.382 2.055 . . . . 0.0 111.657 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 16.7 p -130.69 137.85 49.75 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.883 -175.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.603 ' HD2' ' H ' ' A' ' 170' ' ' ARG . 0.1 OUTLIER -66.22 146.04 99.01 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.509 178.112 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 27.9 Cg_exo -62.53 126.82 19.21 Favored 'Trans proline' 0 C--O 1.238 0.481 0 C-N-CA 122.614 2.209 . . . . 0.0 112.104 177.763 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 114.05 51.99 0.47 Allowed Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.78 -0.724 . . . . 0.0 111.594 -178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 96.4 mt -89.1 164.94 14.81 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.073 0.463 . . . . 0.0 111.216 -178.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.599 ' HB3' ' HG2' ' A' ' 177' ' ' GLN . 56.5 t30 -142.0 165.5 27.28 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.257 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.607 ' HE2' ' HA ' ' A' ' 154' ' ' GLN . 27.2 tptp -50.22 -54.85 18.14 Favored 'General case' 0 C--O 1.235 0.293 0 C-N-CA 122.84 0.456 . . . . 0.0 111.546 -178.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -62.36 -39.49 93.29 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.332 -179.14 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.599 ' HG2' ' HB3' ' A' ' 174' ' ' ASN . 8.6 mm100 -64.42 -38.56 91.44 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.54 0.686 . . . . 0.0 109.978 -178.794 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.609 HD12 HG12 ' A' ' 155' ' ' VAL . 96.6 mt -61.9 -44.86 95.93 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.929 176.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 45.7 t -59.27 -50.34 80.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.219 0 O-C-N 123.58 0.55 . . . . 0.0 111.36 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -56.41 -53.71 54.23 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.619 0.247 . . . . 0.0 111.476 -178.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 64.1 mt -62.63 -40.71 89.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 CA-C-O 120.714 0.292 . . . . 0.0 111.036 -178.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.451 HG23 ' NZ ' ' A' ' 162' ' ' LYS . 39.2 t -64.64 -47.82 87.32 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.571 0 C-N-CA 120.871 -0.332 . . . . 0.0 110.22 178.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -62.32 -36.28 92.84 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.249 -0.5 . . . . 0.0 112.349 179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.2 t -58.63 -47.4 84.52 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.972 0.415 . . . . 0.0 110.317 177.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -80.13 -28.44 38.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.91 179.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -61.0 -47.68 85.33 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.137 -177.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -74.53 -3.66 32.27 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 -178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -106.94 17.29 23.28 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.991 -178.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.675 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.4 mt -87.98 117.74 68.82 Favored Pre-proline 0 C--O 1.233 0.231 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.881 178.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 3.3 Cg_exo -74.64 100.07 1.29 Allowed 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.863 2.375 . . . . 0.0 111.0 175.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.445 ' CG1' ' HG3' ' B' ' 482' ' ' GLU . 13.3 p -115.46 135.2 56.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.061 -173.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -108.05 125.72 51.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.027 178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.465 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 31.0 tt0 -50.97 -59.71 3.86 Favored 'General case' 0 C--N 1.328 -0.358 0 O-C-N 123.63 0.581 . . . . 0.0 112.39 -176.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -51.8 -58.21 7.09 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 112.656 0.614 . . . . 0.0 112.656 -173.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.02 -41.5 97.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.084 -176.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 54.7 m -65.92 -42.85 89.58 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.099 -176.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.476 ' O ' HG13 ' A' ' 201' ' ' ILE . 53.1 mt -59.46 -43.84 93.11 Favored 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 176.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 41.8 m -59.5 -48.41 81.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.771 178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 56.9 m -58.96 -49.15 78.94 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.788 0.328 . . . . 0.0 110.626 179.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.669 ' CD1' HD22 ' B' ' 488' ' ' LEU . 46.2 t80 -59.35 -60.39 3.93 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.699 -176.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.511 HD11 ' HE2' ' B' ' 468' ' ' PHE . 46.9 mt -58.11 -44.7 87.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-O 121.002 0.43 . . . . 0.0 110.497 -175.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -61.87 -41.21 97.59 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.966 -178.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -63.56 -51.67 64.39 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.801 -179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.561 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.3 t -65.69 -28.8 45.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.226 -175.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 23.4 mtm180 -84.62 -1.21 55.67 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -177.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -116.77 -46.46 2.74 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.427 173.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.786 ' HB3' ' HB3' ' A' ' 210' ' ' LYS . 15.8 t70 -172.78 137.34 0.76 Allowed 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 175.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 4.5 mptt -77.27 91.33 3.78 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.495 -176.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 64.3 t30 62.72 78.68 0.28 Allowed 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.114 -0.948 . . . . 0.0 109.785 -174.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.786 ' HB3' ' HB3' ' A' ' 207' ' ' ASP . 14.5 ptmm? -82.92 139.95 33.1 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.37 -175.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 26.7 m -78.36 160.97 27.51 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.839 174.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -82.12 122.3 27.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.506 -0.316 . . . . 0.0 110.588 179.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 80.3 mt -116.56 97.88 6.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.633 -178.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . 0.402 ' HB3' ' OD2' ' A' ' 216' ' ' ASP . 65.3 mttp -78.47 -55.94 4.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.56 179.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 62.43 20.62 12.02 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.539 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . 0.402 ' OD2' ' HB3' ' A' ' 214' ' ' LYS . 40.3 m-20 -76.02 -33.82 59.68 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.245 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 34.8 p 47.16 76.16 0.11 Allowed 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.317 -0.856 . . . . 0.0 112.208 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -98.88 -72.98 1.07 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.731 -0.947 . . . . 0.0 110.731 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 32.7 t 58.55 88.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 121.427 0.632 . . . . 0.0 111.784 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 61.2 t-80 . . . . . 0 C--O 1.246 0.92 0 CA-C-O 118.709 -0.662 . . . . 0.0 109.581 176.845 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.477 0.884 0 CA-C-O 120.692 0.282 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -93.15 101.67 13.96 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -85.15 117.49 24.13 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.279 -176.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 48.2 t -103.21 -44.85 5.07 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.108 179.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -162.99 -48.84 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.413 -176.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 27.1 t-80 -59.67 108.93 0.81 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.802 -178.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 137.74 -33.31 2.28 Favored Glycine 0 N--CA 1.445 -0.74 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.747 -178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 7.1 p -154.81 128.54 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.007 0.432 . . . . 0.0 111.013 -178.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 144.36 30.83 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.444 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.8 p -70.09 -22.78 63.01 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.062 0.458 . . . . 0.0 110.975 -179.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -59.16 -42.84 91.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.703 -0.681 . . . . 0.0 109.791 176.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 5.8 t -64.15 -35.74 81.77 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.387 -0.824 . . . . 0.0 110.284 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 53.8 tp -62.36 -44.44 96.48 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.099 177.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.543 ' O ' HG23 ' B' ' 471' ' ' VAL . 59.3 t80 -53.24 -55.02 27.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.511 ' HE2' HD11 ' A' ' 201' ' ' ILE . 63.5 m-85 -65.49 -32.35 73.91 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -176.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.13 -40.51 97.79 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.216 0.531 . . . . 0.0 110.253 175.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -68.19 -44.12 76.58 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.537 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.543 HG23 ' O ' ' B' ' 467' ' ' PHE . 59.8 t -55.12 -43.64 71.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.181 0 CA-C-O 121.188 0.518 . . . . 0.0 110.052 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 28.9 mtt-85 -57.09 -53.0 63.06 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.799 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 38.4 ttpt -73.28 -33.63 65.33 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.729 -174.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.572 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -73.62 -47.93 36.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.773 -176.171 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.8 mp -69.26 -34.45 74.8 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.791 -178.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 73.3 ttt180 71.65 -40.54 0.48 Allowed 'General case' 0 N--CA 1.469 0.493 0 O-C-N 123.937 0.773 . . . . 0.0 112.298 176.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 22.8 t -83.97 127.98 34.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.829 0.347 . . . . 0.0 110.387 -175.314 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -57.93 -46.51 84.91 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.664 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -72.21 -24.91 61.47 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.07 -176.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . . . . . . . . . . . -67.86 -42.02 81.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.129 0.49 . . . . 0.0 109.826 176.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 73.0 t80 -66.69 -35.58 80.48 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 109.485 -0.561 . . . . 0.0 109.485 175.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 41.6 tt0 -62.52 -43.07 99.7 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.231 175.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -54.3 -45.87 72.66 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.628 176.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.559 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 82.3 t80 -54.98 -49.05 72.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.3 176.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 193' ' ' GLU . 89.1 mt -63.94 -34.47 78.05 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.548 -179.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.675 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.5 mtt180 -67.66 -36.8 81.41 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.101 0.477 . . . . 0.0 110.349 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 60.2 m -62.53 -34.03 76.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.707 174.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.669 HD22 ' CD1' ' A' ' 200' ' ' PHE . 50.5 mt -68.04 -44.2 76.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.869 -0.605 . . . . 0.0 111.412 -179.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.477 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.8 m -66.72 -42.87 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 C-N-CA 120.772 -0.371 . . . . 0.0 111.401 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.433 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 19.3 pt -69.66 -26.79 31.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.752 178.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.1 t80 -67.88 -39.33 83.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.102 0.477 . . . . 0.0 110.149 173.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -71.69 -26.12 62.37 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.965 -178.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -93.6 18.07 10.64 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.488 -177.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 64.78 14.58 9.25 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.562 0.538 . . . . 0.0 111.762 176.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.548 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 62.0 t -76.37 -41.5 35.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-O 120.852 0.358 . . . . 0.0 110.355 -177.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.44 HG22 ' CG2' ' A' ' 157' ' ' THR . 37.1 pt -122.39 169.63 13.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.975 176.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 9.0 t -121.01 -176.0 3.17 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.618 ' HG3' ' HB3' ' B' ' 523' ' ' LEU . 22.9 ttm180 -57.53 -48.13 80.13 Favored 'General case' 0 C--N 1.331 -0.224 0 O-C-N 123.164 0.29 . . . . 0.0 111.639 -176.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . 0.416 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -56.79 -54.55 45.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.742 -174.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.615 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 1.7 pm0 -69.69 -32.49 71.14 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.522 -179.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 61.5 tp -58.32 -49.71 76.22 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.189 0.518 . . . . 0.0 110.272 176.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.807 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 99.3 t -64.07 -39.81 86.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.676 178.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.457 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 98.4 mt-30 -71.3 -24.96 62.24 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.202 -0.454 . . . . 0.0 112.093 -178.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.615 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 79.7 mt -70.46 -40.46 73.7 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 122.154 -0.341 . . . . 0.0 111.233 179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.528 HG22 ' HG ' ' B' ' 509' ' ' LEU . 6.5 p -91.16 5.33 5.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 121.364 0.602 . . . . 0.0 110.552 -178.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.558 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 9.5 t -58.41 -48.64 96.59 Favored Pre-proline 0 CA--C 1.542 0.643 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.345 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.558 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 33.7 Cg_exo -61.93 -9.3 13.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 C-N-CA 122.353 2.036 . . . . 0.0 112.998 176.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -107.25 -60.03 1.74 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.252 -175.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.528 ' HG ' HG22 ' B' ' 505' ' ' VAL . 82.6 mt -90.25 -12.75 37.01 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.602 -0.272 . . . . 0.0 110.943 -175.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -68.03 -7.07 48.82 Favored Glycine 0 C--N 1.33 0.218 0 C-N-CA 121.104 -0.569 . . . . 0.0 112.706 -177.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 52.1 mttm -84.92 -17.35 38.07 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.236 0.541 . . . . 0.0 109.739 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.572 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 51.2 m-85 -122.48 97.93 44.23 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.136 -175.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -52.6 -52.18 9.46 Favored 'Trans proline' 0 C--N 1.342 0.237 0 C-N-CA 123.437 2.758 . . . . 0.0 113.596 -173.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.3 pm0 -66.85 -30.78 71.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.871 0.367 . . . . 0.0 111.3 -176.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 29.6 tp -78.09 -43.78 28.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.189 0.519 . . . . 0.0 109.988 -178.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.447 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 9.2 t80 -67.8 -31.86 72.02 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.719 177.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -66.86 -42.92 84.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.794 176.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 2.0 t90 -54.18 -49.79 68.51 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.807 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 73.5 t80 -58.78 -59.48 5.35 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.87 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -57.0 -40.21 76.17 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.698 0.259 . . . . 0.0 111.698 -176.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -62.84 -37.7 87.85 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.937 0.399 . . . . 0.0 110.653 178.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -67.83 -47.23 69.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.902 -179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.618 ' HB3' ' HG3' ' B' ' 498' ' ' ARG . 3.8 mm? -70.57 -17.4 62.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.887 -177.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.91 32.59 12.44 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.376 -0.916 . . . . 0.0 111.382 -175.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 21.3 t80 -101.28 95.32 6.44 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 176.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 66.5 tttp -68.73 -18.69 64.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.481 -174.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 65.69 59.52 0.75 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -176.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 29.4 m . . . . . 0 C--O 1.248 1.018 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.41 -178.273 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 N--CA 1.474 0.77 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -88.1 -24.41 23.41 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.653 0.264 . . . . 0.0 111.276 179.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -124.38 120.65 32.73 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.529 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -120.84 152.97 16.72 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.495 -0.642 . . . . 0.0 111.495 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.2 t -141.28 88.5 2.16 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.036 0.446 . . . . 0.0 110.278 -179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -72.66 124.13 24.67 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 179.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -100.6 139.27 36.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 120.91 0.386 . . . . 0.0 111.017 -179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -130.07 22.35 5.3 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.835 -0.621 . . . . 0.0 109.939 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 108.73 97.88 2.52 Favored Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.767 -0.651 . . . . 0.0 111.891 -175.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -66.17 144.39 46.15 Favored Glycine 0 N--CA 1.449 -0.499 0 C-N-CA 121.042 -0.599 . . . . 0.0 112.413 179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -99.2 18.55 17.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.779 0.323 . . . . 0.0 110.759 -178.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 32.8 t -54.12 131.79 59.83 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 115.877 -0.602 . . . . 0.0 110.869 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.45 127.61 26.94 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.92 2.414 . . . . 0.0 112.005 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 61.5 t 60.52 88.26 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.232 0.18 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.506 -173.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -89.72 94.97 10.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.641 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -95.49 -19.13 20.09 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.707 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 42.2 mt 70.99 144.4 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.265 0 CA-C-N 115.088 -0.96 . . . . 0.0 111.551 177.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -88.8 -65.27 1.03 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 175.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 98.9 m -160.5 112.88 1.36 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.52 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.542 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 26.7 Cg_exo -62.32 136.49 60.0 Favored 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.444 2.096 . . . . 0.0 111.285 177.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -95.86 133.67 39.75 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 121.245 0.545 . . . . 0.0 111.856 -176.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.5 p -92.75 102.97 14.17 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.819 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.457 177.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.61 117.93 13.79 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.54 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 79.1 mt -96.45 1.9 52.03 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.13 0.49 . . . . 0.0 110.764 -179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -80.37 -26.99 38.31 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.729 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.621 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 6.1 pt20 -67.45 -20.91 65.56 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.153 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.554 HD11 HD21 ' B' ' 504' ' ' LEU . 73.0 mt -72.11 165.81 23.58 Favored 'General case' 0 C--O 1.237 0.429 0 CA-C-O 121.368 0.604 . . . . 0.0 112.182 -174.214 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . 0.55 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 23.0 mt-30 -72.2 154.15 41.2 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.552 175.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 35.1 t -63.12 -46.01 97.15 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.029 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -61.48 -33.15 73.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.631 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.55 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 48.2 m -61.93 -50.92 70.2 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.012 178.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.2 mt -64.3 -39.4 93.85 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.126 0.489 . . . . 0.0 110.775 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 77.8 mtp180 -67.96 -30.39 69.66 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.765 178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.555 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.9 ttm180 -70.4 -40.86 73.65 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 -179.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.57 ' HA ' HG13 ' B' ' 495' ' ' VAL . 61.6 t80 -57.03 -52.25 66.04 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.27 173.576 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.57 ' HB3' ' NZ ' ' A' ' 162' ' ' LYS . 9.2 mtpm? -59.63 -33.62 71.74 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.992 -178.112 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 32.6 ttm180 -78.19 -42.96 29.89 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 120.769 0.319 . . . . 0.0 111.232 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 7.0 m-70 -67.07 -42.42 84.74 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -178.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -92.47 -1.38 57.02 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -177.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.7 mmtm 58.2 79.46 0.21 Allowed 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.504 0.503 . . . . 0.0 111.597 178.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.735 HD23 HG22 ' A' ' 181' ' ' ILE . 11.0 mp -103.27 120.02 53.33 Favored Pre-proline 0 C--N 1.326 -0.421 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.76 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.504 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 12.9 Cg_exo -68.97 129.71 18.94 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 123.572 2.848 . . . . 0.0 112.464 -175.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.448 HG21 HD11 ' A' ' 173' ' ' LEU . 8.9 t -178.48 169.57 1.75 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.925 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 171' ' ' PRO . 16.4 ptp180 -82.6 147.3 55.36 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.375 178.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 170' ' ' ARG . 15.5 Cg_exo -69.36 132.65 24.43 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.684 2.256 . . . . 0.0 112.195 179.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 101.35 55.42 0.91 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.58 177.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.448 HD11 HG21 ' A' ' 169' ' ' THR . 81.9 mt -95.03 148.25 22.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.622 0.248 . . . . 0.0 110.644 -179.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.453 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 31.5 m-80 -85.43 177.9 7.62 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.268 -0.423 . . . . 0.0 110.612 175.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.635 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.9 tptm -57.8 -52.59 64.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.388 -177.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -57.8 -40.26 79.5 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.872 0.368 . . . . 0.0 111.159 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -59.56 -48.02 83.29 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.332 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 91.2 mt -60.49 -48.71 80.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.138 -179.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.635 HG23 ' O ' ' A' ' 175' ' ' LYS . 23.2 t -58.8 -46.68 90.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.302 -175.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -68.29 -39.32 82.12 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.445 -177.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.735 HG22 HD23 ' A' ' 167' ' ' LEU . 70.7 mt -67.78 -47.34 80.01 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 120.805 0.336 . . . . 0.0 110.748 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.62 -47.29 85.76 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 177.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.78 -36.07 92.2 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.563 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 25.0 t -62.58 -39.54 94.02 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.853 0.359 . . . . 0.0 110.683 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.5 t-80 -85.86 -31.75 22.07 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.765 0.317 . . . . 0.0 110.995 179.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 69.1 t80 -63.54 -40.54 97.3 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 122.843 0.457 . . . . 0.0 112.131 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -74.41 -6.55 48.86 Favored 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 121.096 -0.241 . . . . 0.0 111.55 -177.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 62.8 m -111.89 23.38 13.87 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -177.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.883 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 76.0 mt -84.17 116.04 63.01 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.672 0.272 . . . . 0.0 110.953 177.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 6.2 Cg_exo -74.41 105.59 2.08 Favored 'Trans proline' 0 N--CA 1.462 -0.337 0 C-N-CA 123.073 2.516 . . . . 0.0 110.751 174.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.473 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.8 p -108.65 143.43 18.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.895 0.378 . . . . 0.0 111.368 -172.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -110.78 113.24 25.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.183 -0.462 . . . . 0.0 109.943 177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.542 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 47.7 tt0 -46.01 -60.28 2.36 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 -174.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -60.17 -53.68 54.8 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 112.198 0.444 . . . . 0.0 112.198 -173.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -63.96 -39.51 94.31 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.884 0.373 . . . . 0.0 110.834 -176.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 75.4 m -64.74 -43.73 92.43 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.023 -178.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 63.6 mt -60.82 -45.06 95.9 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 176.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -56.91 -47.0 81.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.675 179.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 83.2 m -61.09 -50.78 71.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.417 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.581 ' CD1' HD22 ' B' ' 488' ' ' LEU . 87.1 t80 -60.93 -49.71 76.34 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.081 -177.485 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.459 HD11 ' HE2' ' B' ' 468' ' ' PHE . 83.9 mt -57.71 -49.95 79.1 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.382 -177.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . 0.411 ' O ' ' HB2' ' A' ' 206' ' ' ASN . 7.9 m-85 -63.27 -33.11 74.8 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.419 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 42.4 m -69.2 -53.21 21.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.709 0.29 . . . . 0.0 110.715 178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 200' ' ' PHE . 15.2 t -66.72 -25.42 34.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.787 0.327 . . . . 0.0 110.987 -176.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 18.5 mtp180 -87.4 1.01 54.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.696 -0.229 . . . . 0.0 111.567 176.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.411 ' HB2' ' O ' ' A' ' 202' ' ' TYR . 0.3 OUTLIER -138.62 -82.79 0.3 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.515 0.198 . . . . 0.0 111.137 178.28 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -119.66 109.03 15.17 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.64 -56.51 20.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.04 0.448 . . . . 0.0 110.941 -177.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -161.82 29.46 0.12 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.429 0.633 . . . . 0.0 109.875 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.415 ' C ' ' HD2' ' A' ' 210' ' ' LYS . 0.0 OUTLIER -135.26 -178.53 5.15 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.081 -176.097 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 5.2 p -151.92 100.38 2.65 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 121.115 0.483 . . . . 0.0 111.071 178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -129.59 2.17 5.0 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.276 178.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . 0.424 HD13 ' HA ' ' A' ' 213' ' ' LEU . 4.1 mm? -89.62 97.21 11.07 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.127 0.489 . . . . 0.0 110.291 178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . 0.526 ' HA ' ' HE3' ' A' ' 214' ' ' LYS . 0.1 OUTLIER -110.08 102.27 11.0 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.778 179.46 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -88.64 163.12 15.96 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.494 178.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.22 -175.8 5.16 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.104 179.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 50.3 m -147.04 105.24 3.76 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.94 0.4 . . . . 0.0 110.295 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -98.39 159.95 20.53 Favored Glycine 0 N--CA 1.449 -0.492 0 C-N-CA 120.803 -0.713 . . . . 0.0 111.981 -178.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 11.2 p -83.02 -30.64 8.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-O 121.057 0.456 . . . . 0.0 110.267 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 . . . . . 0 C--O 1.246 0.9 0 CA-C-O 118.666 -0.683 . . . . 0.0 109.682 -178.915 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 21.6 t . . . . . 0 N--CA 1.479 1.022 0 CA-C-O 121.068 0.461 . . . . 0.0 110.28 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 41.3 t30 -88.18 115.26 25.53 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.325 179.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -120.81 -32.87 3.9 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.38 178.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 47.8 m 57.29 52.27 9.02 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.142 178.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 41.0 mmtm -126.91 171.17 11.51 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.659 179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.7 p80 -137.6 160.75 38.31 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -178.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 130.89 -84.92 0.3 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.949 -0.643 . . . . 0.0 111.977 176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 35.8 m -118.12 162.37 16.24 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-O 120.601 0.239 . . . . 0.0 110.605 -179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -177.32 -54.5 0.07 OUTLIER Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.612 -0.804 . . . . 0.0 111.852 177.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . 0.471 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 2.8 p -63.92 -35.79 81.83 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 120.799 0.333 . . . . 0.0 111.632 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.463 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -68.28 -42.82 78.98 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.221 177.436 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.9 m -64.39 -35.53 81.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.022 0.439 . . . . 0.0 110.071 176.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.471 ' HB3' ' O ' ' B' ' 463' ' ' THR . 18.8 tp -55.13 -53.51 55.03 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.915 174.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.536 ' CE1' ' HG ' ' B' ' 515' ' ' LEU . 79.4 t80 -54.15 -52.24 61.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.435 -0.802 . . . . 0.0 112.049 177.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.459 ' HE2' HD11 ' A' ' 201' ' ' ILE . 30.1 m-85 -64.79 -34.99 79.66 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.171 0.434 . . . . 0.0 112.171 -174.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -64.95 -43.12 93.77 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-O 121.33 0.586 . . . . 0.0 109.9 175.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -60.97 -45.6 94.11 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.146 175.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.499 HG23 ' O ' ' B' ' 467' ' ' PHE . 94.0 t -58.89 -40.57 80.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.258 0 CA-C-O 120.859 0.361 . . . . 0.0 110.533 177.063 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 3.4 mmt180 -54.07 -48.28 70.8 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.262 178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . 0.522 ' O ' ' HG3' ' B' ' 476' ' ' ARG . 81.8 tttt -82.94 -35.02 26.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.666 -178.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -66.71 -49.2 66.81 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.27 0.47 . . . . 0.0 112.27 -175.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . 0.413 HD13 HG13 ' B' ' 471' ' ' VAL . 8.6 mp -67.47 -34.05 76.38 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.481 -178.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.522 ' HG3' ' O ' ' B' ' 473' ' ' LYS . 38.4 mtm180 69.0 -58.1 0.5 Allowed 'General case' 0 N--CA 1.47 0.575 0 O-C-N 123.968 0.792 . . . . 0.0 112.377 176.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 29.0 t -67.54 129.96 41.55 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.849 0.357 . . . . 0.0 110.191 -179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.58 -31.22 71.12 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.496 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -70.47 -36.62 74.0 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.111 0.482 . . . . 0.0 109.871 176.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.542 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.41 -45.73 78.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.4 177.18 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.416 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 70.5 t80 -65.29 -39.5 92.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.105 178.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.488 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 36.8 tt0 -59.25 -42.68 91.69 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.243 175.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.62 -43.05 99.57 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.613 -179.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 69.4 t80 -56.4 -45.88 80.42 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.582 174.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.473 ' HB3' HG21 ' A' ' 191' ' ' VAL . 93.1 mt -66.12 -33.37 75.64 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.927 -179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.883 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 10.7 mtt85 -66.52 -36.7 83.33 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.052 0.453 . . . . 0.0 110.178 176.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 58.2 m -61.21 -37.24 82.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 121.119 0.485 . . . . 0.0 109.776 172.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.581 HD22 ' CD1' ' A' ' 200' ' ' PHE . 38.6 mt -64.92 -46.99 79.36 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.473 -179.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 17.1 m -64.18 -41.26 91.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 C-N-CA 120.99 -0.284 . . . . 0.0 111.562 -178.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.42 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 30.0 pt -69.42 -34.92 64.53 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 120.043 -0.663 . . . . 0.0 111.209 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . 0.638 ' HB2' HD23 ' B' ' 501' ' ' LEU . 90.0 t80 -61.65 -47.08 87.0 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.157 0.503 . . . . 0.0 109.846 172.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -61.38 -35.11 76.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.547 -178.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -87.59 13.98 9.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.512 -178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.87 24.12 14.37 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.034 0.445 . . . . 0.0 111.121 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.57 HG13 ' HA ' ' A' ' 161' ' ' TYR . 78.4 t -76.43 -39.11 33.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.644 -179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.616 HD11 HD22 ' B' ' 501' ' ' LEU . 30.9 pt -132.26 158.94 43.39 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.205 178.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 3.6 p -94.69 -178.3 4.49 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.814 0.34 . . . . 0.0 111.792 -176.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.486 ' O ' HG23 ' B' ' 502' ' ' VAL . 41.4 ttp180 -55.67 -55.09 36.28 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.735 -175.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . 0.507 ' O ' ' HG3' ' B' ' 503' ' ' GLN . . . -58.67 -39.93 82.07 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.5 -176.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 6.3 mm-40 -61.61 -43.16 99.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.805 0.336 . . . . 0.0 110.385 -178.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.638 HD23 ' HB2' ' B' ' 491' ' ' PHE . 0.2 OUTLIER -59.09 -50.58 73.52 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 121.542 0.687 . . . . 0.0 109.747 177.877 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.486 HG23 ' O ' ' B' ' 498' ' ' ARG . 58.0 t -60.64 -35.19 62.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 114.704 -1.135 . . . . 0.0 111.097 -177.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.621 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 75.9 mt-30 -79.15 -35.8 41.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.675 -178.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.554 HD21 HD11 ' A' ' 153' ' ' LEU . 67.3 mt -68.19 -38.62 82.18 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.876 0.37 . . . . 0.0 111.44 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.559 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.6 p -86.26 1.43 5.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.126 0.489 . . . . 0.0 110.877 -179.767 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.563 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.2 t -60.54 -47.74 95.38 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.813 178.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.572 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 32.4 Cg_exo -62.24 -7.08 9.37 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.285 1.99 . . . . 0.0 112.715 175.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -104.15 -58.25 1.91 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.833 0.349 . . . . 0.0 110.766 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.559 ' HG ' HG22 ' B' ' 505' ' ' VAL . 80.9 mt -88.49 -2.06 58.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.497 -174.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -65.83 -18.05 65.88 Favored Glycine 0 C--O 1.229 -0.177 0 C-N-CA 121.084 -0.579 . . . . 0.0 113.08 -178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.572 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 2.5 mptp? -92.21 -2.94 56.21 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.252 0.549 . . . . 0.0 109.645 178.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -127.55 85.25 61.28 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.542 -0.754 . . . . 0.0 109.853 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -52.16 -44.51 45.47 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 123.174 2.583 . . . . 0.0 112.927 -175.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -59.63 -46.27 89.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.024 179.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.536 ' HG ' ' CE1' ' B' ' 467' ' ' PHE . 2.2 tp -69.86 -40.73 75.59 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.736 -175.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.458 ' CE2' ' HD2' ' B' ' 520' ' ' LYS . 49.6 t80 -66.4 -41.76 88.86 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.2 179.14 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -63.23 -45.06 93.4 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.41 178.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.463 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 36.7 t90 -56.65 -48.6 77.21 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.145 178.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.604 ' CZ ' HD12 ' B' ' 501' ' ' LEU . 8.8 t80 -58.43 -47.29 84.43 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.701 -0.682 . . . . 0.0 110.856 -177.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.458 ' HD2' ' CE2' ' B' ' 516' ' ' PHE . 50.6 mtpt -61.11 -42.49 98.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.758 178.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -65.56 -43.84 88.63 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.257 -178.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -65.35 -45.51 83.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.89 0.376 . . . . 0.0 110.548 -178.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . . . . . . . . . 89.4 mt -71.15 -26.91 63.2 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.608 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 87.78 36.6 8.42 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.732 -0.747 . . . . 0.0 111.668 -177.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -90.84 115.98 28.32 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -133.96 17.69 3.82 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.109 0.48 . . . . 0.0 110.461 -176.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -84.78 22.08 1.42 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.874 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 13.4 p . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.617 -0.706 . . . . 0.0 110.488 -178.616 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -74.79 -41.6 59.7 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.226 -177.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -125.23 -73.34 0.64 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.628 179.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 62.28 -148.19 48.81 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.101 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 8.2 t -79.5 123.15 27.29 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -149.75 -70.94 0.19 Allowed 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.073 0.463 . . . . 0.0 110.158 -177.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -173.42 175.01 3.15 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 -179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 17.8 t70 69.22 110.71 0.05 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.439 0.638 . . . . 0.0 111.769 178.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . 0.719 ' HA3' ' HA ' ' A' ' 139' ' ' PRO . . . -132.86 162.52 24.19 Favored Glycine 0 N--CA 1.447 -0.599 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.682 177.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . 0.41 ' O ' ' HB3' ' A' ' 137' ' ' ASP . . . -83.47 107.05 2.88 Favored Glycine 0 N--CA 1.446 -0.652 0 C-N-CA 120.705 -0.759 . . . . 0.0 111.688 179.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 136' ' ' GLY . 14.0 t70 70.59 -65.67 0.32 Allowed 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.369 0.668 . . . . 0.0 110.878 -175.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 37.0 m -109.98 103.74 54.11 Favored Pre-proline 0 C--N 1.322 -0.611 0 CA-C-N 116.186 -0.461 . . . . 0.0 109.992 178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.719 ' HA ' ' HA3' ' A' ' 135' ' ' GLY . 37.7 Cg_endo -67.56 -38.64 13.92 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.584 2.19 . . . . 0.0 112.051 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 46.3 t -77.47 117.69 22.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.166 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -86.91 149.22 24.96 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.134 -0.484 . . . . 0.0 109.987 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.1 t70 68.51 104.11 0.05 Allowed 'General case' 0 N--CA 1.465 0.308 0 O-C-N 123.932 0.77 . . . . 0.0 110.241 -175.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 1.2 pp -82.44 139.33 18.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.484 0.659 . . . . 0.0 112.545 -173.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.527 ' O ' ' HB2' ' B' ' 477' ' ' SER . 8.4 t70 -89.8 -54.98 3.81 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.935 -1.03 . . . . 0.0 108.366 167.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 39.3 m -157.81 106.88 1.78 Allowed Pre-proline 0 N--CA 1.452 -0.37 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.403 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.434 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 10.7 Cg_exo -70.19 162.34 42.66 Favored 'Trans proline' 0 C--O 1.234 0.285 0 C-N-CA 122.392 2.061 . . . . 0.0 111.045 176.14 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -114.67 146.58 40.72 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.028 0.442 . . . . 0.0 111.422 -175.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.4 p -106.65 124.48 62.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.71 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -88.6 135.37 33.53 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.214 175.291 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.51 HD13 HG12 ' A' ' 182' ' ' VAL . 94.5 mt -114.71 0.63 13.93 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.428 178.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.54 ' HA ' HG21 ' A' ' 179' ' ' VAL . 31.1 t80 -75.78 -25.41 56.41 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -66.67 -24.71 66.31 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.742 175.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.596 HD21 HD21 ' B' ' 504' ' ' LEU . 26.0 mt -62.48 147.95 47.23 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-O 120.852 0.358 . . . . 0.0 110.668 -177.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . 0.401 ' O ' ' HG ' ' A' ' 158' ' ' LEU . 17.9 mp0 -62.52 145.33 54.54 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.56 176.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 178' ' ' LEU . 5.6 p -57.32 -35.58 49.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.588 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -73.26 -33.82 65.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.898 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 34.6 m -65.02 -40.0 94.23 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.161 0.505 . . . . 0.0 110.07 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.547 HD21 ' HB2' ' A' ' 153' ' ' LEU . 29.2 mt -65.71 -38.95 90.63 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-O 121.487 0.66 . . . . 0.0 110.02 175.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -62.68 -39.39 93.8 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 114.672 -1.149 . . . . 0.0 110.225 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.502 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 6.6 ttm180 -68.03 -44.32 76.72 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.929 -178.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.674 ' HA ' HG13 ' B' ' 495' ' ' VAL . 65.8 t80 -51.77 -57.9 7.95 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.871 176.413 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.516 ' HG2' ' O ' ' A' ' 158' ' ' LEU . 2.6 ptpp? -68.95 -32.4 71.96 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 -174.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -73.2 -36.65 66.55 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.967 0.413 . . . . 0.0 110.682 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -76.74 -31.37 57.07 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.702 -176.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 50.2 m-85 -92.97 -4.46 52.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.767 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm 60.71 60.31 1.94 Allowed 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.154 0.502 . . . . 0.0 111.18 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 89.5 mt -91.53 136.22 26.98 Favored Pre-proline 0 C--N 1.322 -0.59 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.061 179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 25.7 Cg_exo -61.83 125.4 16.5 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 122.485 2.123 . . . . 0.0 111.861 -178.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.49 ' HB ' HD11 ' A' ' 173' ' ' LEU . 19.5 p -134.0 164.7 26.71 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.261 -179.375 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -126.92 144.72 51.25 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.377 176.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.38 130.84 37.63 Favored 'Trans proline' 0 C--O 1.233 0.227 0 C-N-CA 122.772 2.315 . . . . 0.0 112.525 -177.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 106.61 36.66 2.57 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.992 -0.623 . . . . 0.0 111.561 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.49 HD11 ' HB ' ' A' ' 169' ' ' THR . 87.2 mt -73.62 167.94 20.33 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.275 0.559 . . . . 0.0 111.764 -178.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.587 ' HB3' ' HG3' ' A' ' 177' ' ' GLN . 26.2 t-20 -137.82 157.93 45.4 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.386 -0.825 . . . . 0.0 109.412 -178.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.471 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.6 tptm -46.57 -52.75 12.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 122.704 0.402 . . . . 0.0 111.07 177.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.74 -42.23 98.69 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.183 -179.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.587 ' HG3' ' HB3' ' A' ' 174' ' ' ASN . 21.5 mt-30 -63.09 -38.01 89.5 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.231 0.539 . . . . 0.0 110.345 -179.096 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.654 HD12 HG23 ' A' ' 155' ' ' VAL . 89.0 mt -64.13 -41.64 97.14 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.113 178.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.54 HG21 ' HA ' ' A' ' 151' ' ' TYR . 80.8 t -62.49 -41.25 91.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 O-C-N 123.782 0.676 . . . . 0.0 111.001 177.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -59.77 -51.19 70.79 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.597 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -60.96 -46.62 96.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.97 179.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.51 HG12 HD13 ' A' ' 150' ' ' LEU . 65.4 t -62.45 -49.16 84.98 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.323 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.434 -179.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.0 -38.85 97.3 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.372 -0.442 . . . . 0.0 112.534 -178.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.0 t -61.78 -44.2 97.35 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.699 0.285 . . . . 0.0 110.75 179.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.4 t-80 -82.13 -29.81 31.46 Favored 'General case' 0 C--N 1.33 -0.241 0 C-N-CA 120.627 -0.429 . . . . 0.0 111.104 -179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.4 t80 -58.89 -41.16 86.52 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.103 0.477 . . . . 0.0 110.498 179.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -77.52 9.45 3.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.598 -0.728 . . . . 0.0 111.503 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 20.4 m -131.4 14.88 5.03 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.528 0.204 . . . . 0.0 111.483 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.641 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 66.5 mt -80.73 119.29 75.75 Favored Pre-proline 0 C--O 1.235 0.305 0 CA-C-O 120.69 0.281 . . . . 0.0 110.997 -179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -73.61 124.52 9.37 Favored 'Trans proline' 0 C--O 1.235 0.353 0 C-N-CA 122.859 2.373 . . . . 0.0 111.118 174.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.584 HG21 ' HB3' ' B' ' 485' ' ' LEU . 11.2 p -142.44 128.46 17.91 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-O 121.458 0.647 . . . . 0.0 112.068 -173.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -98.66 127.55 44.63 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.128 178.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.409 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 41.7 tt0 -54.5 -60.45 3.33 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 122.751 0.42 . . . . 0.0 112.13 -175.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -55.17 -57.3 12.34 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.89 -174.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -60.59 -44.21 96.5 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.622 -176.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 94.9 m -66.13 -41.43 90.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.795 -176.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 49.2 mt -60.19 -45.7 92.22 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 175.691 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 26.3 m -61.56 -41.15 96.97 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.503 -0.771 . . . . 0.0 111.256 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 80.3 m -62.52 -52.06 64.96 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.579 -0.282 . . . . 0.0 110.817 178.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.566 ' O ' HG23 ' A' ' 204' ' ' VAL . 71.2 t80 -57.98 -57.78 11.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.002 -178.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.606 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 78.6 mt -54.46 -55.16 16.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.703 -176.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 35.1 t80 -56.8 -40.27 75.64 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.092 -175.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.9 m -67.44 -48.86 66.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.482 -179.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.566 HG23 ' O ' ' A' ' 200' ' ' PHE . 11.7 t -69.87 -22.55 24.86 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-O 120.936 0.398 . . . . 0.0 110.619 -176.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 10.5 mmm180 -70.31 -27.31 64.28 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.208 173.641 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 89.3 m-20 -94.08 -66.04 0.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.744 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -140.05 130.92 26.02 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.659 0.742 . . . . 0.0 109.593 178.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.739 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 59.7 mttp -83.33 57.44 3.99 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.879 -178.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 61.26 73.9 0.46 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.548 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -101.1 1.99 39.87 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.839 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 21.2 t -62.01 -37.26 84.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.678 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -110.94 -59.23 1.99 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.855 -178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 45.6 tp -77.54 116.43 18.1 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.063 -176.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -109.3 121.71 45.76 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.854 -0.612 . . . . 0.0 109.995 178.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 64.94 90.4 0.09 Allowed 'General case' 0 N--CA 1.464 0.266 0 O-C-N 124.082 0.864 . . . . 0.0 111.55 179.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -86.05 125.67 33.6 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.242 179.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 24.7 m 58.47 54.3 5.63 Favored 'General case' 0 C--N 1.33 -0.276 0 O-C-N 123.587 0.554 . . . . 0.0 111.066 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -76.62 -19.43 77.94 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 120.909 -0.663 . . . . 0.0 111.946 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 30.1 m -63.69 133.2 29.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 120.993 0.425 . . . . 0.0 110.788 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.81 -0.614 . . . . 0.0 109.841 -178.234 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 24.4 m . . . . . 0 N--CA 1.475 0.819 0 CA-C-O 120.732 0.301 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -76.27 -45.08 34.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.928 0.394 . . . . 0.0 110.256 177.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -101.31 100.25 10.73 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.778 -0.647 . . . . 0.0 110.708 178.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 24.5 m -84.75 -32.87 23.21 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.376 178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -128.89 157.55 41.28 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.046 -179.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 32.0 t-80 -134.83 129.3 34.28 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -97.73 -159.4 30.69 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.536 -0.84 . . . . 0.0 112.573 -177.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 9.7 p -80.83 -30.76 12.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.087 0.47 . . . . 0.0 110.477 179.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 179.91 167.09 36.52 Favored Glycine 0 N--CA 1.444 -0.792 0 C-N-CA 120.996 -0.621 . . . . 0.0 111.913 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 4.6 t -90.96 -0.1 57.66 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.69 0.281 . . . . 0.0 110.865 -179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 42.7 mp0 -59.34 -54.8 42.66 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.437 179.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 60.9 m -58.17 -31.53 67.35 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.988 0.423 . . . . 0.0 111.353 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.408 ' C ' HD23 ' B' ' 466' ' ' LEU . 9.5 tt -64.05 -49.69 71.36 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.876 -0.602 . . . . 0.0 109.683 176.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.496 ' O ' HG23 ' B' ' 471' ' ' VAL . 70.3 t80 -57.05 -56.39 22.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.332 177.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 70.4 m-85 -62.87 -33.24 74.87 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -173.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -66.6 -44.19 82.79 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 120.553 -0.459 . . . . 0.0 110.068 176.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -61.92 -43.44 98.85 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.759 176.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.496 HG23 ' O ' ' B' ' 467' ' ' PHE . 86.0 t -58.6 -47.67 87.92 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.21 0 CA-C-O 121.038 0.447 . . . . 0.0 110.817 177.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.96 -39.51 81.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.423 -179.004 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -76.92 -41.59 42.91 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.232 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.539 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -70.31 -46.02 65.1 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.976 -174.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.6 mp -69.23 -29.62 67.6 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.71 -178.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 68.8 ttt180 70.72 -60.43 0.5 Allowed 'General case' 0 N--CA 1.466 0.337 0 O-C-N 124.006 0.816 . . . . 0.0 111.833 175.37 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.527 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 17.1 t -67.04 127.94 34.46 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.996 -177.263 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.03 -23.05 64.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.709 176.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 4.0 mp0 -75.08 -40.66 59.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.698 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.434 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -67.17 -42.26 84.57 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.228 176.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.513 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 65.4 t80 -65.81 -32.02 73.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.193 -0.458 . . . . 0.0 109.866 176.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HD3' ' B' ' 486' ' ' ARG . 34.9 tt0 -64.47 -44.58 90.61 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.338 -0.615 . . . . 0.0 109.338 175.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -55.81 -44.81 78.21 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.423 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 81.9 t80 -55.43 -44.29 76.16 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.294 0.569 . . . . 0.0 109.978 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.584 ' HB3' HG21 ' A' ' 191' ' ' VAL . 89.3 mt -69.27 -31.19 69.54 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.615 -0.721 . . . . 0.0 111.354 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.641 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.1 OUTLIER -60.89 -44.06 97.61 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.041 0.448 . . . . 0.0 109.995 173.083 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.0 m -61.23 -36.79 80.91 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.199 177.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 45.6 mt -67.48 -47.6 69.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.463 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 14.3 m -65.19 -41.24 91.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.161 0 C-N-CA 120.894 -0.322 . . . . 0.0 111.845 -177.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.478 HG12 ' O ' ' B' ' 486' ' ' ARG . 16.1 pt -70.27 -32.94 52.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.944 178.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 75.2 t80 -63.68 -44.08 94.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.081 0.467 . . . . 0.0 109.96 173.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 10.8 t30 -66.12 -34.01 77.08 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.533 -179.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -87.79 21.98 2.46 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.856 -178.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 63.3 25.24 14.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.025 0.441 . . . . 0.0 111.86 172.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.674 HG13 ' HA ' ' A' ' 161' ' ' TYR . 75.5 t -88.71 -48.47 14.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.34 -177.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 44.1 pt -116.69 160.02 16.35 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.671 0 C-N-CA 120.724 -0.391 . . . . 0.0 110.463 -179.548 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.451 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 33.2 m -96.79 -174.0 2.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.18 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.739 ' HD2' ' HB3' ' A' ' 208' ' ' LYS . 20.5 mtp-105 -64.37 -53.35 50.07 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 112.485 0.55 . . . . 0.0 112.485 -176.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.21 -48.8 77.89 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -171.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.565 ' HA ' ' HG2' ' B' ' 503' ' ' GLN . 2.5 pm0 -66.29 -32.8 74.42 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 121.073 -0.251 . . . . 0.0 110.828 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.587 HD23 HD21 ' B' ' 523' ' ' LEU . 60.6 tp -58.81 -44.72 90.9 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.824 0.345 . . . . 0.0 110.487 176.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.507 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.3 OUTLIER -69.82 -41.49 79.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.671 -178.528 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.565 ' HG2' ' HA ' ' B' ' 500' ' ' GLU . 18.8 pt20 -73.71 -23.33 59.77 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -173.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 153' ' ' LEU . 85.4 mt -66.8 -38.31 86.24 Favored 'General case' 0 C--N 1.328 -0.354 0 O-C-N 121.954 -0.466 . . . . 0.0 110.905 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.622 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.9 p -89.55 6.56 4.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 121.304 0.573 . . . . 0.0 110.599 -179.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.495 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.5 t -61.14 -46.32 95.99 Favored Pre-proline 0 CA--C 1.543 0.711 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.851 178.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.571 ' O ' ' HE2' ' B' ' 511' ' ' LYS . 48.8 Cg_exo -58.63 -16.37 30.06 Favored 'Trans proline' 0 C--N 1.358 1.063 0 C-N-CA 122.172 1.915 . . . . 0.0 112.765 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -99.95 -52.76 3.34 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.888 -176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.736 HD22 HD23 ' B' ' 515' ' ' LEU . 76.8 mt -92.09 0.86 57.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.592 -0.276 . . . . 0.0 111.634 -175.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.6 -17.17 68.61 Favored Glycine 0 C--O 1.23 -0.156 0 C-N-CA 120.841 -0.695 . . . . 0.0 112.513 -179.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.571 ' HE2' ' O ' ' B' ' 507' ' ' PRO . 3.2 mptp? -90.94 -3.54 57.22 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.388 0.614 . . . . 0.0 109.46 178.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.539 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 43.4 m-85 -129.0 84.79 61.99 Favored Pre-proline 0 N--CA 1.448 -0.567 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.968 -174.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -52.95 -49.78 16.4 Favored 'Trans proline' 0 C--N 1.345 0.371 0 C-N-CA 123.42 2.747 . . . . 0.0 112.893 -173.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -61.98 -34.03 75.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.385 -177.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.736 HD23 HD22 ' B' ' 509' ' ' LEU . 9.8 tp -78.12 -43.78 27.96 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.377 -173.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.61 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 52.4 t80 -68.13 -37.31 80.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.091 178.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -68.42 -34.04 75.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.21 178.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 23.9 t90 -59.41 -48.47 81.5 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 175.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.529 ' O ' HD13 ' B' ' 523' ' ' LEU . 3.2 t80 -58.04 -44.03 87.15 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.487 -0.778 . . . . 0.0 110.185 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.61 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 88.7 mttt -60.16 -44.07 95.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.073 175.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -63.87 -39.51 94.37 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.508 -178.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -70.55 -31.58 68.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.44 0.638 . . . . 0.0 110.045 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.587 HD21 HD23 ' B' ' 501' ' ' LEU . 10.6 mp -88.1 1.19 54.89 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.924 177.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 59.25 37.31 91.65 Favored Glycine 0 C--N 1.331 0.253 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.025 -178.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . 0.4 ' HD2' ' HG2' ' B' ' 520' ' ' LYS . 19.2 t80 -101.39 114.17 27.92 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.143 0.497 . . . . 0.0 110.944 -175.112 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.0 mttp -98.91 131.24 45.14 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.623 175.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -140.32 88.4 2.21 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 13.2 m . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.522 -0.752 . . . . 0.0 110.378 -178.179 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 28.3 t . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.33 0.11 . . . . 0.0 110.89 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 13.4 t30 66.71 99.19 0.05 OUTLIER 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.263 0.554 . . . . 0.0 111.489 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 65.41 25.93 11.96 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.698 177.296 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -163.33 -172.15 30.46 Favored Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.314 -0.946 . . . . 0.0 112.717 -179.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 39.7 t -139.31 120.09 14.3 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -121.74 160.52 24.38 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.916 0.389 . . . . 0.0 111.088 -177.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -133.92 138.32 45.44 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.875 177.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -107.46 18.22 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.237 0.542 . . . . 0.0 110.604 -175.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 88.0 164.41 40.2 Favored Glycine 0 N--CA 1.447 -0.599 0 C-N-CA 120.84 -0.695 . . . . 0.0 111.835 -178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 151.7 -154.82 25.79 Favored Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.848 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -141.21 133.4 27.96 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 178.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 10.3 p -61.53 121.88 67.06 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-O 121.066 0.46 . . . . 0.0 111.474 -177.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -70.68 175.09 9.34 Favored 'Trans proline' 0 C--O 1.235 0.351 0 C-N-CA 122.795 2.33 . . . . 0.0 112.132 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.7 m -76.18 141.03 16.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 175.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 -100.14 66.97 1.36 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.573 0.701 . . . . 0.0 110.813 -177.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 12.7 p-10 -90.98 -16.53 27.84 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.216 -0.902 . . . . 0.0 109.153 174.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.544 HG21 ' HG3' ' A' ' 146' ' ' PRO . 15.0 mt 66.03 132.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.501 178.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.443 ' O ' ' HB2' ' B' ' 477' ' ' SER . 32.3 t70 -93.27 -56.0 3.11 Favored 'General case' 0 C--N 1.314 -0.956 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 175.532 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 79.7 m -161.39 111.13 1.23 Allowed Pre-proline 0 C--N 1.327 -0.376 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.473 176.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.544 ' HG3' HG21 ' A' ' 143' ' ' ILE . 15.2 Cg_exo -68.59 142.98 55.14 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.823 2.349 . . . . 0.0 111.612 175.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -100.73 141.32 33.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.46 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.6 p -84.44 129.39 37.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-O 121.129 0.49 . . . . 0.0 110.561 178.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.528 ' HB3' ' NE2' ' A' ' 152' ' ' GLN . 10.9 t70 -81.31 100.63 9.29 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.06 3.29 53.71 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.2 0.524 . . . . 0.0 110.668 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -76.6 -27.63 55.84 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 174.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.619 ' HG2' ' HB3' ' B' ' 503' ' ' GLN . 0.0 OUTLIER -51.82 -41.5 61.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 114.467 -1.242 . . . . 0.0 111.824 171.51 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.582 HD21 HD11 ' B' ' 504' ' ' LEU . 64.5 mt -61.01 128.19 35.23 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.837 -178.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -62.36 160.86 12.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.521 177.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.2 t -54.7 -44.18 69.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 121.122 0.486 . . . . 0.0 110.362 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 5.5 m-20 -65.59 -37.97 88.15 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.057 -179.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.408 HG21 HD22 ' A' ' 153' ' ' LEU . 10.6 m -64.35 -45.2 88.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.987 0.422 . . . . 0.0 110.556 178.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 71.8 mt -59.86 -46.84 88.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.584 177.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 65.5 mtp180 -63.84 -34.94 79.06 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.84 178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' B' ' 494' ' ' GLU . 13.7 ttm180 -66.1 -46.47 77.5 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.561 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.44 ' HA ' HG13 ' B' ' 495' ' ' VAL . 83.7 t80 -52.52 -48.02 66.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.365 173.534 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.588 ' HZ3' ' HB2' ' A' ' 167' ' ' LEU . 6.5 mtpm? -65.46 -34.78 79.08 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.427 -178.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.1 tpt180 -75.27 -40.54 58.67 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 120.762 0.315 . . . . 0.0 111.032 -176.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -74.48 -43.71 54.78 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.804 0.335 . . . . 0.0 111.327 -178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.439 ' CE1' HG22 ' B' ' 490' ' ' ILE . 39.2 m-85 -85.48 0.24 52.92 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.353 -179.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp 57.39 73.12 0.48 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.433 176.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.588 ' HB2' ' HZ3' ' A' ' 162' ' ' LYS . 76.0 mt -113.69 135.23 21.95 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.856 -178.204 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_exo -58.16 157.4 25.63 Favored 'Trans proline' 0 C--O 1.238 0.476 0 C-N-CA 123.243 2.629 . . . . 0.0 112.381 179.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.544 ' HB ' HD11 ' A' ' 173' ' ' LEU . 13.8 p -139.5 106.61 5.47 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.43 -178.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 170' ' ' ARG . 7.9 ptp180 -64.35 150.31 93.23 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.182 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.74 128.07 21.22 Favored 'Trans proline' 0 C--O 1.234 0.323 0 C-N-CA 122.541 2.161 . . . . 0.0 111.812 177.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 100.41 57.25 0.89 Allowed Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.802 -0.713 . . . . 0.0 111.775 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.544 HD11 ' HB ' ' A' ' 169' ' ' THR . 83.3 mt -83.78 142.71 30.47 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.297 0.57 . . . . 0.0 111.748 -179.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.761 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 14.0 m120 -138.54 179.75 6.28 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.166 -0.924 . . . . 0.0 109.033 178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.4 ' O ' HG23 ' A' ' 179' ' ' VAL . 27.7 tptp -57.4 -53.45 58.02 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 120.881 0.372 . . . . 0.0 110.798 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.89 -27.84 67.01 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.295 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.761 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 31.5 mm-40 -67.77 -44.76 76.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.42 0.629 . . . . 0.0 110.154 179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.559 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 91.2 mt -64.13 -42.71 96.72 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.837 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 175' ' ' LYS . 67.9 t -60.66 -42.41 91.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.544 179.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 177' ' ' GLN . 8.0 pt-20 -67.94 -40.85 83.23 Favored 'General case' 0 C--N 1.328 -0.326 0 C-N-CA 120.752 -0.379 . . . . 0.0 111.259 -177.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.409 ' N ' ' HG3' ' A' ' 180' ' ' GLU . 60.0 mt -67.46 -48.71 76.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 CA-C-O 120.916 0.389 . . . . 0.0 110.257 176.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.402 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 55.0 t -58.21 -49.05 83.02 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.394 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.706 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.46 -38.39 96.28 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.546 -177.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 46.7 t -59.05 -46.41 88.31 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.969 0.414 . . . . 0.0 110.619 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.77 -26.28 31.99 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.231 -179.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.494 ' HE1' HD13 ' B' ' 490' ' ' ILE . 35.6 t80 -66.33 -34.85 78.91 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.176 -177.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -78.33 10.23 3.23 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.611 177.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 15.9 p -136.09 38.82 2.75 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.948 0.404 . . . . 0.0 111.332 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.89 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 73.8 mt -102.39 115.75 63.98 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.436 176.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -67.86 113.22 2.92 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 122.669 2.246 . . . . 0.0 111.918 177.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.603 HG21 ' HB3' ' B' ' 485' ' ' LEU . 9.1 p -115.75 154.21 17.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.72 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.761 -175.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -118.62 112.89 20.43 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.561 ' HA ' HD22 ' B' ' 485' ' ' LEU . 32.6 tt0 -51.3 -65.06 0.62 Allowed 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 -173.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 7.0 tmtm? -58.4 -48.9 79.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.571 0.224 . . . . 0.0 111.356 -177.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -66.46 -45.76 78.66 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.837 -174.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . 0.52 ' HB ' HD23 ' B' ' 485' ' ' LEU . 85.3 m -68.7 -37.37 79.48 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.848 -0.16 . . . . 0.0 110.903 -176.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 53.3 mt -60.73 -47.34 86.75 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 40.7 m -57.91 -47.2 83.52 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.644 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.8 t -59.4 -48.24 82.4 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.57 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.54 ' CG ' HD22 ' B' ' 488' ' ' LEU . 68.8 t80 -64.63 -47.95 76.67 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 111.285 -178.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' B' ' 468' ' ' PHE . 78.8 mt -57.44 -44.62 84.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.021 -177.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -71.07 -35.0 71.73 Favored 'General case' 0 C--N 1.33 -0.243 0 C-N-CA 121.077 -0.249 . . . . 0.0 111.185 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 73.8 m -60.89 -50.23 74.27 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.733 0.301 . . . . 0.0 110.866 178.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 200' ' ' PHE . 20.4 t -71.48 -33.51 49.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.064 -177.025 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 63.1 mtt180 -69.15 -27.04 65.19 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.456 178.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -69.74 -63.4 1.08 Allowed 'General case' 0 C--O 1.235 0.322 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 175.521 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -178.09 177.95 0.97 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 175.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.45 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 11.0 mptt -101.7 118.72 37.51 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 116.468 -0.333 . . . . 0.0 110.749 -178.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.39 114.61 3.6 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.522 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -161.07 -81.23 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.103 -0.499 . . . . 0.0 109.739 -177.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 49.5 m 61.96 -176.15 0.13 Allowed 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 121.244 0.545 . . . . 0.0 112.147 175.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -158.15 -45.43 0.06 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.324 179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 67.3 tp -98.91 105.7 17.87 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.885 0.374 . . . . 0.0 110.551 177.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -120.65 11.74 11.31 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.627 0.727 . . . . 0.0 109.204 178.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -103.8 13.99 31.84 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.833 179.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -91.83 -47.94 7.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.022 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.8 m -82.05 84.83 6.87 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.731 178.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -90.58 -88.39 1.35 Allowed Glycine 0 N--CA 1.449 -0.469 0 N-CA-C 111.231 -0.748 . . . . 0.0 111.231 176.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 14.7 p -94.49 -21.49 5.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-O 121.537 0.684 . . . . 0.0 109.343 175.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 19.0 t-80 . . . . . 0 C--O 1.245 0.856 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.976 176.521 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.835 0.35 . . . . 0.0 110.072 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -94.9 99.83 11.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.03 0.443 . . . . 0.0 110.665 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -120.06 -26.15 5.61 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.422 179.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 35.1 t -82.49 147.39 28.72 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.605 178.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 43.3 tptt -64.26 -36.26 83.51 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.226 0.536 . . . . 0.0 109.763 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -144.68 119.8 10.1 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.048 173.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -79.34 -171.68 41.62 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.43 -175.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . 0.683 HG13 ' HB2' ' B' ' 464' ' ' GLU . 59.5 t -90.54 121.04 40.43 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 109.723 -0.473 . . . . 0.0 109.723 179.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -133.27 -72.54 0.09 OUTLIER Glycine 0 N--CA 1.445 -0.755 0 C-N-CA 120.504 -0.855 . . . . 0.0 112.115 -176.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' B' ' 466' ' ' LEU . 1.9 p -72.79 -25.3 61.11 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.695 0.283 . . . . 0.0 111.075 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.683 ' HB2' HG13 ' B' ' 461' ' ' VAL . 50.9 mp0 -62.93 -51.21 67.81 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.909 177.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 17.0 t -63.93 -33.32 75.44 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.95 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.44 ' O ' ' HG3' ' B' ' 470' ' ' LYS . 42.7 tp -58.17 -53.9 53.07 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.169 175.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.451 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.3 t80 -54.03 -55.07 30.85 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.925 177.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.473 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.6 m-85 -61.36 -39.5 90.85 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -174.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -63.8 -39.93 95.42 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 120.82 0.343 . . . . 0.0 110.337 177.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' B' ' 466' ' ' LEU . 96.3 mttt -63.01 -46.25 88.53 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.184 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.451 HG23 ' O ' ' B' ' 467' ' ' PHE . 85.5 t -57.09 -44.47 83.17 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-O 121.139 0.495 . . . . 0.0 110.521 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 4.2 tmm_? -58.43 -42.33 87.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.967 -179.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -80.28 -44.86 18.89 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.686 -0.234 . . . . 0.0 111.035 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.511 ' HB1' ' CZ ' ' B' ' 512' ' ' PHE . . . -61.88 -42.45 99.08 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' B' ' 477' ' ' SER . 10.6 mp -71.57 -37.95 71.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.427 -0.352 . . . . 0.0 110.217 178.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 ttp85 70.48 -36.78 0.37 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.976 0.91 . . . . 0.0 111.935 177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.1 t -80.51 121.6 25.98 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.901 0.382 . . . . 0.0 110.875 178.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -63.27 -30.95 72.0 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.706 177.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -63.34 -42.0 98.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.843 -0.617 . . . . 0.0 110.147 177.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.52 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -72.06 -40.98 67.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.243 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.548 ' O ' HD12 ' B' ' 485' ' ' LEU . 72.9 t80 -62.51 -45.01 94.94 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.395 0.617 . . . . 0.0 109.481 177.57 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.522 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 38.9 tt0 -57.29 -43.94 83.6 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.038 176.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -56.71 -43.92 81.05 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.801 178.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -54.77 -51.44 65.73 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.92 175.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.603 ' HB3' HG21 ' A' ' 191' ' ' VAL . 1.5 mp -66.01 -26.25 67.45 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 111.99 0.367 . . . . 0.0 111.99 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.89 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 22.0 mtt85 -68.0 -37.35 81.36 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 120.339 -0.544 . . . . 0.0 109.801 174.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 47.6 m -63.08 -32.01 73.28 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 121.222 0.534 . . . . 0.0 109.741 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.54 HD22 ' CG ' ' A' ' 200' ' ' PHE . 72.0 mt -68.18 -45.71 72.69 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.356 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.493 HG22 ' HA ' ' B' ' 486' ' ' ARG . 19.4 m -66.01 -40.89 88.55 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 C-N-CA 120.916 -0.314 . . . . 0.0 111.555 -178.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.494 HD13 ' HE1' ' A' ' 186' ' ' PHE . 17.3 pt -69.66 -30.82 46.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 C-N-CA 120.457 -0.497 . . . . 0.0 110.829 178.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 91.5 t80 -66.32 -42.15 88.64 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.042 0.449 . . . . 0.0 110.006 174.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -64.6 -35.58 81.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.561 179.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -89.62 26.64 1.69 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.019 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . 0.549 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 12.4 pt-20 46.14 32.41 1.43 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.29 1.036 . . . . 0.0 112.649 177.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.478 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 63.8 t -81.76 -42.55 19.33 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.101 177.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 43.4 pt -116.13 175.87 2.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.461 178.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 16.3 m -115.15 174.95 5.72 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.065 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.46 ' O ' HG23 ' B' ' 502' ' ' VAL . 60.8 ttp180 -57.51 -52.39 65.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.506 0.193 . . . . 0.0 110.675 -179.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -57.5 -46.61 83.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.834 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 5.8 mm-40 -56.02 -50.44 70.91 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.464 178.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.518 HD23 HD21 ' B' ' 523' ' ' LEU . 64.3 tp -59.79 -49.0 79.44 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.405 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.536 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 93.1 t -59.89 -38.52 76.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.729 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.619 ' HB3' ' HG2' ' A' ' 152' ' ' GLN . 16.2 mm100 -72.25 -38.91 68.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.413 179.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.582 HD11 HD21 ' A' ' 153' ' ' LEU . 65.6 mt -58.64 -37.55 76.18 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.475 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.1 p -91.22 6.01 5.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-O 121.056 0.455 . . . . 0.0 111.4 -175.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.606 ' OG ' ' HD3' ' B' ' 507' ' ' PRO . 93.4 p -63.07 -42.17 75.0 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.606 ' HD3' ' OG ' ' B' ' 506' ' ' SER . 25.8 Cg_exo -65.96 -10.49 27.15 Favored 'Trans proline' 0 C--N 1.355 0.904 0 C-N-CA 121.88 1.72 . . . . 0.0 112.367 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -99.16 -57.2 2.22 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.622 -179.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.475 ' HG ' HG22 ' B' ' 505' ' ' VAL . 57.3 mt -92.49 3.04 56.28 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.811 -175.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.59 -22.58 71.67 Favored Glycine 0 N--CA 1.454 -0.12 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.966 -177.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.437 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.7 mptp? -87.37 -2.42 58.6 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 178.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.511 ' CZ ' ' HB1' ' B' ' 474' ' ' ALA . 46.3 m-85 -127.04 90.81 48.44 Favored Pre-proline 0 C--N 1.327 -0.384 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.923 -176.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -58.45 -47.21 20.2 Favored 'Trans proline' 0 C--N 1.343 0.248 0 C-N-CA 123.35 2.7 . . . . 0.0 113.282 -172.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . 0.467 ' CD ' ' H ' ' B' ' 514' ' ' GLU . 0.0 OUTLIER -72.51 -32.72 66.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.898 0.38 . . . . 0.0 110.918 -176.531 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.473 HD23 HD22 ' B' ' 509' ' ' LEU . 15.8 tp -71.31 -43.74 66.5 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.072 -179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.525 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 28.5 t80 -66.61 -34.97 79.06 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.006 -0.543 . . . . 0.0 109.995 177.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -63.87 -39.85 95.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.648 175.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.3 t90 -58.1 -49.06 78.25 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.536 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 37.3 t80 -56.67 -45.86 81.44 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.763 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.525 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.0 mttt -58.87 -39.98 83.02 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.721 0.296 . . . . 0.0 111.471 178.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -71.22 -38.72 72.0 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.304 -175.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 32.9 t80 -64.61 -45.34 87.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.849 -178.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.518 HD21 HD23 ' B' ' 501' ' ' LEU . 5.6 mp -83.28 -2.72 56.34 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 111.667 0.247 . . . . 0.0 111.667 -178.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 64.51 52.32 44.28 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.665 -0.779 . . . . 0.0 111.772 -178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -65.87 93.3 0.18 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 178.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -87.07 116.57 25.22 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 116.012 -0.54 . . . . 0.0 109.707 -178.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -95.55 20.39 9.64 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.077 -176.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 3.6 p . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.289 -0.862 . . . . 0.0 111.01 -179.765 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 46.6 m . . . . . 0 N--CA 1.477 0.912 0 N-CA-C 111.529 0.196 . . . . 0.0 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.3 p-10 -116.66 -0.6 12.33 Favored 'General case' 0 C--O 1.233 0.2 0 C-N-CA 120.544 -0.462 . . . . 0.0 111.64 -179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -93.42 -9.27 39.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.283 0.563 . . . . 0.0 110.376 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 152.55 -109.95 0.43 Allowed Glycine 0 N--CA 1.447 -0.621 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.433 179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 21.4 m 64.56 -174.35 0.17 Allowed 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.03 0.532 . . . . 0.0 111.518 177.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -147.06 172.58 13.52 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.337 -0.616 . . . . 0.0 109.337 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.96 -11.3 42.08 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.0 0.429 . . . . 0.0 111.515 -171.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -100.52 -54.78 2.76 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 120.853 0.359 . . . . 0.0 111.053 -178.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 129.79 62.96 0.1 Allowed Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 121.051 -0.595 . . . . 0.0 111.673 -177.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -80.18 -60.49 2.38 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.094 179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 34.9 t70 62.4 98.06 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 123.111 0.565 . . . . 0.0 111.007 -179.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.9 m 70.81 92.97 0.05 OUTLIER Pre-proline 0 N--CA 1.465 0.317 0 CA-C-N 115.22 -0.9 . . . . 0.0 111.083 -178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -69.86 -32.18 18.64 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.708 2.272 . . . . 0.0 111.852 177.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 28.4 m -110.2 159.94 9.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.658 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -107.14 -162.29 0.83 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.244 -0.434 . . . . 0.0 109.845 178.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 63.89 46.3 3.95 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.375 0.607 . . . . 0.0 109.493 -174.591 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.24 136.76 22.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 114.961 -1.018 . . . . 0.0 109.945 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.487 ' O ' ' HB3' ' B' ' 477' ' ' SER . 19.6 p-10 -80.16 -53.23 6.88 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.35 -0.386 . . . . 0.0 109.989 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 90.3 m -166.14 109.26 0.72 Allowed Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.965 179.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 9.4 Cg_exo -71.35 158.72 53.65 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 122.252 1.968 . . . . 0.0 110.791 173.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -108.82 145.27 35.51 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.029 0.443 . . . . 0.0 111.339 -175.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 2.7 p -102.74 135.76 38.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.774 174.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -105.62 131.99 52.31 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 177.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.424 HD13 HG12 ' A' ' 182' ' ' VAL . 96.2 mt -110.28 5.9 22.08 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.145 0.497 . . . . 0.0 110.471 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -84.99 -24.19 28.36 Favored 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.6 -28.3 69.53 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.437 172.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.503 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -63.75 158.16 22.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.104 0.478 . . . . 0.0 110.989 -178.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . 0.45 HE21 ' CD ' ' B' ' 500' ' ' GLU . 46.6 mt-30 -78.78 148.95 32.76 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.454 177.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.528 HG13 ' CD1' ' A' ' 178' ' ' LEU . 85.6 t -53.96 -45.29 63.9 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.262 0 CA-C-O 121.198 0.523 . . . . 0.0 110.317 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 59.5 t30 -60.3 -36.6 78.26 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.631 -178.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 26.7 m -68.23 -43.75 77.22 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.098 0.475 . . . . 0.0 110.858 179.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.401 HD22 HG21 ' A' ' 182' ' ' VAL . 88.0 mt -65.03 -38.54 91.22 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.352 0.596 . . . . 0.0 110.787 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.451 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 79.9 mtp180 -70.72 -30.59 67.17 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.309 178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.496 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 42.2 ttm105 -70.46 -42.76 71.05 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.651 ' HA ' HG13 ' B' ' 495' ' ' VAL . 52.2 t80 -48.86 -58.2 5.2 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.071 173.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.614 ' HB2' ' HB2' ' A' ' 167' ' ' LEU . 6.4 ptpp? -67.97 -27.37 66.53 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.71 -176.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.409 HH11 ' HD2' ' A' ' 163' ' ' ARG . 38.7 ttm180 -67.81 -51.62 46.5 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.848 0.356 . . . . 0.0 110.948 177.308 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -67.31 -37.2 82.96 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.011 -175.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -88.85 0.15 56.82 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 111.766 0.284 . . . . 0.0 111.766 -178.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt 59.69 74.94 0.42 Allowed 'General case' 0 N--CA 1.464 0.26 0 O-C-N 123.669 0.606 . . . . 0.0 111.984 178.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.614 ' HB2' ' HB2' ' A' ' 162' ' ' LYS . 82.5 mt -117.6 110.63 40.38 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.96 176.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.08 127.38 16.7 Favored 'Trans proline' 0 C--O 1.233 0.265 0 C-N-CA 122.672 2.248 . . . . 0.0 112.129 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.547 HG22 HD13 ' A' ' 181' ' ' ILE . 30.7 p -124.35 163.8 20.96 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.987 0.422 . . . . 0.0 111.9 -175.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 8.4 mpt_? -92.35 151.93 41.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.066 179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -63.54 145.39 91.84 Favored 'Trans proline' 0 C--O 1.235 0.369 0 C-N-CA 122.512 2.141 . . . . 0.0 112.172 178.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 78.94 48.34 7.08 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.223 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.545 HD11 ' HB ' ' A' ' 169' ' ' THR . 97.9 mt -74.75 150.08 39.53 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 120.93 0.395 . . . . 0.0 111.061 178.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.446 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 16.2 t-20 -120.37 167.24 12.52 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.502 ' HD3' HG22 ' A' ' 155' ' ' VAL . 21.7 tptm -54.38 -52.49 61.51 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 122.555 0.342 . . . . 0.0 111.29 -178.627 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . 0.437 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.48 -36.81 76.71 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.349 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.826 HE21 ' HA ' ' A' ' 177' ' ' GLN . 0.0 OUTLIER -64.42 -44.01 92.54 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.15 0.5 . . . . 0.0 110.167 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.528 ' CD1' HG13 ' A' ' 155' ' ' VAL . 85.7 mt -62.38 -41.17 98.43 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.778 -179.509 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 71.2 t -62.28 -43.98 98.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.38 0 O-C-N 123.622 0.576 . . . . 0.0 111.114 179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 48.4 mt-10 -61.05 -44.74 96.94 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.789 0.328 . . . . 0.0 110.771 179.08 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.547 HD13 HG22 ' A' ' 169' ' ' THR . 72.5 mt -63.58 -50.62 77.46 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.581 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.424 HG12 HD13 ' A' ' 150' ' ' LEU . 69.1 t -61.03 -46.18 97.15 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.557 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.21 -40.61 99.28 Favored Glycine 0 N--CA 1.448 -0.546 0 O-C-N 123.368 0.417 . . . . 0.0 112.618 -178.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -60.02 -43.31 95.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 120.917 0.389 . . . . 0.0 110.358 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.4 t-80 -78.87 -28.83 44.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.597 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.1 -29.98 70.39 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.537 -179.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -80.75 0.41 34.77 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.11 176.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 11.8 t -126.1 24.81 6.85 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.892 0.377 . . . . 0.0 110.74 -175.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.848 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.4 mt -90.17 117.47 68.07 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-N 116.572 -0.285 . . . . 0.0 110.885 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -73.67 118.79 5.6 Favored 'Trans proline' 0 N--CA 1.461 -0.415 0 C-N-CA 122.542 2.161 . . . . 0.0 111.157 174.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.431 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -133.42 154.93 39.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.62 0 CA-C-N 116.451 -0.34 . . . . 0.0 110.486 -175.248 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -132.11 128.25 37.73 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 110.232 -0.284 . . . . 0.0 110.232 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.519 ' HG3' ' HE2' ' B' ' 481' ' ' TYR . 34.7 tt0 -51.98 -63.83 1.01 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.94 -175.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.8 tptm -57.08 -53.74 54.69 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.038 0.447 . . . . 0.0 112.059 -174.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -65.61 -46.6 78.71 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.911 -175.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 91.5 m -67.03 -36.7 82.68 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.375 -176.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.493 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 45.0 mt -60.64 -45.86 92.51 Favored 'General case' 0 CA--C 1.518 -0.265 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 173.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 61.1 m -56.97 -45.54 82.8 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.741 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 62.5 m -60.08 -54.52 45.03 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.085 -179.557 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.549 ' CD1' HD22 ' B' ' 488' ' ' LEU . 71.9 t80 -57.27 -48.29 79.27 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.278 -177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.487 ' O ' ' HB2' ' A' ' 205' ' ' ARG . 87.8 mt -61.0 -47.23 94.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.488 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -65.29 -36.45 84.13 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.188 -175.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 71.1 m -69.53 -61.22 1.87 Allowed 'General case' 0 C--N 1.327 -0.375 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.853 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 25.2 t -65.22 -29.12 46.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 N-CA-C 111.94 0.348 . . . . 0.0 111.94 -170.606 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.487 ' HB2' ' O ' ' A' ' 201' ' ' ILE . 11.7 mtp180 -79.63 -3.59 47.86 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 111.903 0.335 . . . . 0.0 111.903 179.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 45.2 m-80 -125.32 -65.64 1.0 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.977 0.417 . . . . 0.0 110.804 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -131.51 104.29 6.89 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.496 0.665 . . . . 0.0 110.178 178.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.7 89.57 6.76 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.519 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 67.1 86.22 0.13 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.524 -172.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.879 ' HD2' ' H ' ' A' ' 210' ' ' LYS . 0.0 OUTLIER -45.76 112.99 0.53 Allowed 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.092 -0.958 . . . . 0.0 112.183 -175.865 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 24.7 m -149.73 -178.73 6.62 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.139 -0.937 . . . . 0.0 109.393 -178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -70.34 -34.57 72.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.638 0.256 . . . . 0.0 110.453 177.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 57.8 tp 68.51 -85.01 0.03 OUTLIER 'General case' 0 C--O 1.233 0.188 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.169 177.159 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt 179.44 117.51 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -178.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -108.86 135.02 50.76 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.707 -178.023 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -105.81 87.35 2.57 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.318 179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 31.4 m -113.64 158.04 21.37 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.212 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 112.03 -81.74 0.29 Allowed Glycine 0 N--CA 1.447 -0.576 0 C-N-CA 120.942 -0.647 . . . . 0.0 111.66 -176.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 35.4 m -125.44 156.51 34.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 120.86 0.362 . . . . 0.0 110.396 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 93.7 m-70 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.355 -0.831 . . . . 0.0 110.668 -179.428 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 42.3 t . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 120.992 0.425 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -84.8 -14.31 48.46 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.041 176.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -87.21 111.82 21.38 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.895 -177.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 17.8 m -94.22 -26.54 16.6 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.097 179.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -106.85 144.31 33.67 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.491 179.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 58.8 m170 60.41 40.2 17.61 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.184 176.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -76.79 48.5 2.66 Favored Glycine 0 CA--C 1.518 0.253 0 C-N-CA 121.047 -0.596 . . . . 0.0 112.521 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 17.3 m -126.08 22.63 3.34 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.197 0.522 . . . . 0.0 110.694 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -75.53 1.83 55.81 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.443 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 10.0 p -69.49 -25.69 64.18 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.632 0.253 . . . . 0.0 111.477 -179.084 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.477 ' HG3' ' HH2' ' B' ' 518' ' ' TRP . 0.8 OUTLIER -63.14 -47.46 82.63 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.096 176.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 19.6 m -60.24 -39.55 87.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.259 177.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 44.9 tp -59.08 -51.74 68.76 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.562 176.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.481 ' O ' HG23 ' B' ' 471' ' ' VAL . 81.6 t80 -53.89 -56.96 12.91 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.739 178.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -64.37 -36.58 84.61 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -173.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -66.45 -41.92 88.38 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.586 -0.446 . . . . 0.0 109.965 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . 0.401 ' HD2' HD13 ' B' ' 515' ' ' LEU . 38.9 ttmt -62.38 -43.95 97.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.067 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.648 HG13 HD21 ' B' ' 509' ' ' LEU . 86.7 t -59.96 -51.91 67.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-O 121.16 0.505 . . . . 0.0 110.782 176.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 25.6 ttp180 -58.7 -34.1 70.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.202 -178.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . 0.448 ' HB2' ' HE3' ' B' ' 473' ' ' LYS . 36.9 ttmt -85.19 -31.93 22.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.511 -176.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -79.89 -39.6 30.1 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.644 -177.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . 0.455 ' C ' ' H ' ' B' ' 477' ' ' SER . 66.0 mt -62.91 -35.65 80.77 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.651 -0.25 . . . . 0.0 110.934 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' B' ' 476' ' ' ARG . 35.4 ttt180 71.81 -28.58 0.19 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.818 0.699 . . . . 0.0 111.836 178.102 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.487 ' HB3' ' O ' ' A' ' 144' ' ' ASP . 1.2 p -96.09 120.39 36.29 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.058 -177.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -62.97 -41.72 99.62 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.768 179.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 39.7 mp0 -60.51 -35.16 75.28 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.084 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.51 -36.8 71.2 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.982 0.42 . . . . 0.0 110.734 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.519 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 44.0 t80 -71.69 -34.57 69.76 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.574 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 42.6 tt0 -62.62 -43.03 99.82 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.12 -0.491 . . . . 0.0 109.709 173.444 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -53.67 -48.58 69.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.705 174.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.447 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 83.9 t80 -55.11 -48.73 73.21 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.525 176.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 95.3 mt -64.53 -32.21 73.75 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.606 -0.724 . . . . 0.0 111.644 -179.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.848 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.6 mtt180 -68.89 -38.22 79.51 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 120.863 -0.335 . . . . 0.0 110.483 178.011 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 42.0 m -60.3 -35.49 75.71 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.013 0.435 . . . . 0.0 109.931 172.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.549 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -65.57 -52.19 54.17 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.067 179.067 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.529 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.4 m -61.81 -39.63 84.11 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -176.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.449 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 17.1 pt -69.83 -31.04 46.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.652 178.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.7 t80 -67.29 -38.22 84.68 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.179 0.514 . . . . 0.0 109.97 171.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . 0.437 HD21 ' HA ' ' A' ' 200' ' ' PHE . 13.4 m120 -72.79 -5.2 36.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.459 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -115.14 13.39 16.8 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.154 177.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 59.29 29.33 18.87 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.322 -0.854 . . . . 0.0 111.472 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.651 HG13 ' HA ' ' A' ' 161' ' ' TYR . 71.4 t -80.59 -51.03 16.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.1 0.476 . . . . 0.0 110.333 178.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.5 pt -108.51 167.15 4.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.15 178.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 27.0 t -101.34 177.75 4.84 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.31 -0.405 . . . . 0.0 109.949 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.568 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 52.5 ttp180 -59.01 -59.46 5.44 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.179 0.514 . . . . 0.0 110.685 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . 0.427 ' HA ' HG23 ' B' ' 502' ' ' VAL . . . -57.35 -40.98 79.21 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.565 -179.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.537 ' HA ' ' NE2' ' B' ' 503' ' ' GLN . 8.8 mm-40 -55.45 -42.81 74.78 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 121.103 0.477 . . . . 0.0 110.213 177.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 10.5 tt -64.84 -45.8 84.6 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.33 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.533 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.1 OUTLIER -64.19 -32.51 57.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 120.403 -0.519 . . . . 0.0 110.516 -179.239 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.537 ' NE2' ' HA ' ' B' ' 500' ' ' GLU . 16.7 mt-30 -68.12 -43.13 79.1 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.145 178.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.503 HD21 HD21 ' A' ' 153' ' ' LEU . 49.3 mt -58.72 -43.51 90.14 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.176 -0.465 . . . . 0.0 112.106 -177.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.537 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -91.58 7.91 4.53 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 121.15 0.5 . . . . 0.0 111.038 -175.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.578 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 20.6 t -59.5 -49.49 92.02 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.927 -178.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 47.3 Cg_exo -59.68 -17.17 40.94 Favored 'Trans proline' 0 C--N 1.358 1.042 0 C-N-CA 122.256 1.971 . . . . 0.0 112.898 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -95.9 -57.32 2.39 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.351 -175.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.663 HD22 HD23 ' B' ' 515' ' ' LEU . 53.2 mt -99.26 -9.4 23.68 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -173.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.16 -23.07 71.27 Favored Glycine 0 N--CA 1.453 -0.194 0 C-N-CA 120.9 -0.667 . . . . 0.0 112.527 -177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.518 ' HZ3' ' HB3' ' B' ' 511' ' ' LYS . 0.8 OUTLIER -78.78 -5.1 52.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.947 0.403 . . . . 0.0 110.667 178.276 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.403 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 65.9 m-85 -122.12 92.46 48.87 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.783 177.269 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 7.7 Cg_endo -49.64 -48.0 20.78 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.606 2.871 . . . . 0.0 113.268 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.84 -34.41 77.87 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-O 121.088 0.471 . . . . 0.0 111.095 -177.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.663 HD23 HD22 ' B' ' 509' ' ' LEU . 12.9 tp -78.44 -43.8 26.31 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.016 -174.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.533 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 11.8 t80 -69.75 -32.27 70.7 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.853 178.454 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . 0.412 ' O ' ' HB2' ' B' ' 520' ' ' LYS . 25.5 t-20 -66.33 -37.68 85.91 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.309 175.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.477 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 27.2 t90 -58.02 -46.98 84.41 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 175.3 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -61.38 -38.5 87.25 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.93 178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' B' ' 516' ' ' PHE . 34.0 mmtp -53.27 -50.52 64.67 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.335 0.588 . . . . 0.0 110.168 174.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.54 -36.27 78.59 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.86 -175.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 64.7 t80 -72.78 -39.32 66.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.543 -174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.568 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 10.6 mp -81.53 -19.58 41.84 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.934 -179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 74.08 28.22 64.83 Favored Glycine 0 N--CA 1.448 -0.561 0 N-CA-C 110.829 -0.908 . . . . 0.0 110.829 -174.678 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 36.9 t80 -82.31 90.07 6.62 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.171 0.51 . . . . 0.0 110.284 -175.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -79.7 97.38 6.55 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.406 179.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -103.29 11.64 36.52 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 177.044 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 47.1 m . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.651 -179.433 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 50.7 m . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.803 0.335 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -113.82 149.46 34.96 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.198 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -148.66 159.26 44.28 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.277 177.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 104.69 -14.95 49.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.686 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 15.8 m -64.1 112.34 2.95 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.117 0.484 . . . . 0.0 110.89 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -97.84 -25.38 15.05 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.498 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -94.49 142.78 27.04 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.356 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 28.4 t70 55.44 63.27 2.13 Favored 'General case' 0 N--CA 1.465 0.319 0 O-C-N 124.015 0.822 . . . . 0.0 110.761 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -92.68 44.55 2.56 Favored Glycine 0 N--CA 1.449 -0.477 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.967 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -108.56 23.86 23.44 Favored Glycine 0 N--CA 1.443 -0.895 0 C-N-CA 120.828 -0.701 . . . . 0.0 111.668 179.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.19 104.79 0.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.257 0.551 . . . . 0.0 110.618 179.726 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 5.3 m -133.25 101.84 13.31 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.174 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -60.21 -67.27 0.05 OUTLIER 'Trans proline' 0 C--N 1.343 0.264 0 C-N-CA 122.981 2.454 . . . . 0.0 112.126 178.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.42 ' O ' HG12 ' A' ' 140' ' ' VAL . 10.8 t 64.26 22.64 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.997 0.903 . . . . 0.0 110.3 178.362 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.532 ' HG3' ' HA ' ' B' ' 474' ' ' ALA . 78.9 mm-40 -110.95 113.79 26.62 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.736 178.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -79.19 -8.93 59.4 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.551 -178.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.558 HG21 ' HG3' ' A' ' 146' ' ' PRO . 16.7 mt -58.64 134.76 23.49 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.231 178.601 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.503 ' O ' ' HB2' ' B' ' 477' ' ' SER . 26.8 t70 -90.91 -57.31 2.86 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.873 178.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 82.2 m -165.61 104.58 0.74 Allowed Pre-proline 0 C--N 1.326 -0.416 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.773 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.558 ' HG3' HG21 ' A' ' 143' ' ' ILE . 11.4 Cg_exo -69.68 155.18 66.88 Favored 'Trans proline' 0 N--CA 1.463 -0.311 0 C-N-CA 122.711 2.274 . . . . 0.0 111.686 178.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -107.59 163.91 12.67 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.718 -178.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.8 p -119.85 121.37 65.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-O 121.205 0.526 . . . . 0.0 110.819 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -74.2 118.61 17.36 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.073 176.014 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 62.5 mt -106.72 -6.9 17.52 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.96 0.41 . . . . 0.0 110.841 178.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.491 ' HA ' HG21 ' A' ' 179' ' ' VAL . 1.9 t80 -75.21 -14.29 60.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.393 0.615 . . . . 0.0 109.345 176.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 pt20 -74.27 -24.64 59.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.177 -0.92 . . . . 0.0 110.9 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.696 HD21 HD21 ' B' ' 504' ' ' LEU . 29.7 mt -68.58 160.25 30.38 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.26 0.552 . . . . 0.0 111.42 -173.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -78.12 156.24 30.05 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.308 -0.86 . . . . 0.0 110.094 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.46 HG13 ' CD1' ' A' ' 178' ' ' LEU . 50.2 t -58.92 -44.27 90.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 110.002 -0.37 . . . . 0.0 110.002 177.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -56.97 -44.54 82.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.671 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.722 HG21 ' HG2' ' B' ' 500' ' ' GLU . 35.8 m -62.93 -48.38 79.15 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.112 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 95.5 mt -63.28 -44.61 94.61 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.836 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 155' ' ' VAL . 50.5 mtp180 -65.18 -35.88 82.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.615 178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . . . . . . . . . 32.8 ttm180 -68.14 -43.82 77.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.612 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -53.26 -50.0 65.73 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-O 121.074 0.464 . . . . 0.0 110.302 174.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.566 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 59.7 mtpt -67.83 -29.02 68.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.615 -177.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.416 ' O ' ' HD3' ' A' ' 166' ' ' LYS . 44.6 ttm180 -79.72 -43.64 22.26 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.629 0.252 . . . . 0.0 111.024 179.262 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -69.15 -42.66 75.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.737 0.304 . . . . 0.0 110.631 -177.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 43.9 m-85 -84.28 -1.31 55.07 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.53 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . 0.416 ' HD3' ' O ' ' A' ' 163' ' ' ARG . 71.7 mmtt 58.35 66.74 1.04 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.464 178.29 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.523 HD13 HG22 ' A' ' 181' ' ' ILE . 94.6 mt -101.18 137.31 19.66 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.499 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -62.34 139.63 78.23 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.825 2.35 . . . . 0.0 111.953 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 37.6 p -131.65 147.27 52.5 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.954 179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 67.4 mtt180 -114.37 145.56 34.0 Favored Pre-proline 0 C--N 1.321 -0.665 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -55.31 129.04 33.07 Favored 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 122.894 2.396 . . . . 0.0 111.724 179.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 105.36 48.72 1.03 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.702 -0.761 . . . . 0.0 111.307 -176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 88.0 mt -83.16 144.5 29.79 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 121.362 0.601 . . . . 0.0 111.183 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.631 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 17.8 m120 -137.14 176.35 8.79 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.015 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -55.84 -48.73 74.97 Favored 'General case' 0 C--N 1.328 -0.357 0 O-C-N 123.386 0.429 . . . . 0.0 110.698 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -63.48 -39.11 93.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.248 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.631 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 27.9 mm-40 -60.76 -40.42 92.43 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.454 0.645 . . . . 0.0 110.644 -178.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.613 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 81.7 mt -63.61 -51.88 63.33 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.745 177.432 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.491 HG21 ' HA ' ' A' ' 151' ' ' TYR . 96.7 t -56.58 -47.03 82.72 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 123.622 0.576 . . . . 0.0 111.695 -179.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 50.8 mt-10 -57.52 -49.18 77.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.465 -178.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.566 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 65.8 mt -70.6 -42.88 78.04 Favored 'Isoleucine or valine' 0 C--O 1.24 0.596 0 CA-C-O 120.843 0.354 . . . . 0.0 111.038 -179.311 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 178' ' ' LEU . 56.0 t -59.26 -49.38 83.67 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.389 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.426 178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -64.68 -37.54 94.51 Favored Glycine 0 N--CA 1.449 -0.478 0 C-N-CA 121.424 -0.417 . . . . 0.0 112.661 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.9 t -57.9 -43.05 85.9 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 120.912 0.387 . . . . 0.0 110.586 178.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 -86.65 -27.59 23.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.832 0.348 . . . . 0.0 111.17 -179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.471 ' HE1' HD13 ' B' ' 490' ' ' ILE . 50.3 t80 -61.77 -42.73 99.36 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.153 -176.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.3 mtpp -78.19 17.94 0.57 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 -179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 34.9 p -140.59 19.72 2.36 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 121.074 -0.25 . . . . 0.0 111.457 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.985 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 81.6 mt -78.7 124.03 85.25 Favored Pre-proline 0 C--O 1.234 0.265 0 CA-C-N 116.749 -0.205 . . . . 0.0 110.735 179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -69.96 140.55 42.18 Favored 'Trans proline' 0 N--CA 1.463 -0.269 0 C-N-CA 122.252 1.968 . . . . 0.0 110.907 174.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 4.3 p -150.95 155.78 6.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 C-N-CA 120.933 -0.307 . . . . 0.0 110.919 -173.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -125.32 115.17 19.92 Favored 'General case' 0 C--O 1.224 -0.287 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 -179.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.3 tt0 -47.78 -64.76 0.7 Allowed 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -172.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -64.7 -45.84 84.91 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -173.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.24 -41.54 89.87 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.769 0.319 . . . . 0.0 110.92 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 99.5 m -66.13 -40.16 90.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.917 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 50.0 mt -58.82 -46.68 87.07 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 174.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 55.8 m -56.04 -48.81 75.3 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.426 -0.806 . . . . 0.0 110.741 179.024 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 60.3 m -57.21 -55.23 37.4 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.236 177.289 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.637 ' CD1' HD22 ' B' ' 488' ' ' LEU . 41.6 t80 -52.03 -52.94 47.61 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.562 -178.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.541 HD11 ' HE2' ' B' ' 468' ' ' PHE . 84.4 mt -56.71 -55.35 20.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.248 -177.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 67.9 m-85 -73.21 -29.74 63.02 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -173.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 70.1 m -63.81 -55.27 24.22 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.343 176.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD23 ' B' ' 523' ' ' LEU . 58.2 t -65.18 -32.21 57.26 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.637 -175.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.452 ' HD3' HG22 ' A' ' 201' ' ' ILE . 23.8 mtp180 -72.94 -5.29 37.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.165 -0.47 . . . . 0.0 112.168 179.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -122.7 -54.44 1.85 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.481 0.182 . . . . 0.0 111.379 179.102 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -127.8 167.87 15.93 Favored 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 -177.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -140.2 13.29 2.41 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.165 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 95.6 m-20 63.97 6.87 3.01 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.786 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -134.39 42.51 2.86 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 29.5 m -97.6 -7.33 31.41 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.4 -0.818 . . . . 0.0 111.041 -175.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -120.2 126.36 50.46 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.071 176.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . 0.41 HD12 ' N ' ' A' ' 213' ' ' LEU . 6.3 mp -109.27 -39.06 5.34 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.745 -174.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.04 82.89 3.84 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.632 -176.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -95.28 129.42 42.42 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.565 178.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -81.2 -173.59 4.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.114 -0.493 . . . . 0.0 109.785 176.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 47.9 t -73.63 99.38 3.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.264 0.554 . . . . 0.0 111.033 -177.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -88.44 36.14 3.48 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.987 -0.625 . . . . 0.0 111.786 175.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 42.4 t -114.02 140.67 33.4 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 N-CA-C 110.059 -0.349 . . . . 0.0 110.059 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 54.0 t-80 . . . . . 0 C--O 1.247 0.929 0 CA-C-O 118.216 -0.897 . . . . 0.0 109.644 179.04 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 11.4 p . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 120.747 0.308 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -92.78 115.05 27.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.815 0.341 . . . . 0.0 110.68 -178.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -135.56 129.83 33.59 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.44 179.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 14.4 m -120.45 173.51 7.11 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.272 -178.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 49.0 tptt -101.1 131.78 46.87 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.029 0.442 . . . . 0.0 110.482 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -133.53 147.8 51.61 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.979 177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 71.08 -173.58 42.15 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 121.061 -0.59 . . . . 0.0 112.827 179.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 20.3 m -119.54 -169.16 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 CA-C-O 120.718 0.294 . . . . 0.0 110.648 178.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 123.39 -2.09 9.59 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.948 -0.644 . . . . 0.0 111.543 -178.044 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.0 p -86.11 -15.52 40.88 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.901 0.382 . . . . 0.0 110.732 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.475 ' HA ' ' CH2' ' B' ' 518' ' ' TRP . 3.4 mp0 -58.78 -43.53 90.45 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.752 178.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 15.9 m -63.57 -33.01 74.66 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.003 -179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 54.8 tp -65.59 -43.25 90.29 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.21 0.528 . . . . 0.0 109.862 177.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.452 ' O ' HG23 ' B' ' 471' ' ' VAL . 64.6 t80 -54.96 -49.19 72.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.994 173.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.541 ' HE2' HD11 ' A' ' 201' ' ' ILE . 31.1 m-85 -66.18 -32.07 73.29 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.77 -177.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -60.91 -46.31 91.17 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 174.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -60.91 -49.08 78.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.834 176.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.452 HG23 ' O ' ' B' ' 467' ' ' PHE . 92.5 t -59.49 -51.71 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 120.841 0.353 . . . . 0.0 111.345 -178.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 13.3 ttt180 -58.97 -41.68 88.13 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.519 -176.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' B' ' 473' ' ' LYS . 21.9 ttmt -75.77 -34.35 60.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.326 -0.852 . . . . 0.0 111.317 -175.757 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.532 ' HA ' ' HG3' ' A' ' 141' ' ' GLN . . . -79.82 -41.27 26.75 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.716 -177.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.1 mp -66.56 -41.96 87.81 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 121.101 -0.239 . . . . 0.0 110.831 -179.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.41 HH11 ' HD3' ' B' ' 476' ' ' ARG . 40.2 ttt180 70.6 -56.12 0.61 Allowed 'General case' 0 N--CA 1.472 0.642 0 O-C-N 123.847 0.717 . . . . 0.0 111.688 176.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.503 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 28.4 t -65.89 129.62 40.4 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.082 -179.192 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.02 -40.95 87.38 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.946 -179.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -68.88 -31.11 69.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.842 0.353 . . . . 0.0 110.054 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.472 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -71.64 -43.51 65.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.734 177.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.491 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 76.8 t80 -65.54 -39.67 91.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.138 0.494 . . . . 0.0 109.751 176.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.573 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.5 tt0 -60.09 -43.56 95.43 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.847 174.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 7.8 t30 -55.11 -44.7 75.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.821 178.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.472 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 51.2 t80 -57.53 -48.52 79.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.312 175.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 193' ' ' GLU . 87.2 mt -63.91 -33.1 74.95 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.171 -179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.985 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 20.0 mtt85 -66.12 -38.17 87.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.928 0.394 . . . . 0.0 110.452 177.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 53.7 m -62.03 -34.34 76.05 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 173.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.637 HD22 ' CD1' ' A' ' 200' ' ' PHE . 34.9 mt -68.11 -46.85 69.78 Favored 'General case' 0 N--CA 1.456 -0.165 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.412 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.498 HG22 ' HA ' ' B' ' 486' ' ' ARG . 15.6 m -64.85 -42.57 95.22 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.149 0 C-N-CA 120.947 -0.301 . . . . 0.0 111.634 -178.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.471 HD13 ' HE1' ' A' ' 186' ' ' PHE . 22.9 pt -69.51 -29.59 42.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 C-N-CA 120.264 -0.574 . . . . 0.0 110.848 179.332 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 84.1 t80 -65.33 -42.47 92.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.105 0.479 . . . . 0.0 109.889 172.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -67.26 -32.57 73.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.56 -0.745 . . . . 0.0 110.965 -179.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -83.53 7.8 16.01 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.1 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 65.62 21.8 11.68 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.371 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.459 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 95.2 t -75.5 -43.07 42.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.973 0.416 . . . . 0.0 110.096 178.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.53 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 36.2 pt -120.17 154.96 23.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.717 177.513 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 28.3 p -98.99 -171.3 2.06 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 120.763 -0.375 . . . . 0.0 110.292 178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.567 ' O ' HG23 ' B' ' 502' ' ' VAL . 45.2 ttp180 -55.77 -42.12 75.05 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.419 -179.382 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -60.23 -53.4 58.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.571 -173.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.722 ' HG2' HG21 ' A' ' 157' ' ' THR . 2.3 mp0 -60.63 -41.72 95.44 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.78 -179.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 60.3 tp -58.51 -41.99 86.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.763 -179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.567 HG23 ' O ' ' B' ' 498' ' ' ARG . 67.3 t -69.4 -40.71 80.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.894 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -74.68 -41.65 59.89 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.176 -175.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.696 HD21 HD21 ' A' ' 153' ' ' LEU . 91.0 mt -61.26 -36.92 81.34 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.005 0.431 . . . . 0.0 111.636 -175.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.735 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -92.16 6.81 5.51 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.969 -177.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.526 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 34.9 t -59.77 -48.33 95.37 Favored Pre-proline 0 CA--C 1.54 0.559 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.737 179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.526 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 24.0 Cg_exo -66.3 -1.56 5.69 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 121.946 1.764 . . . . 0.0 112.731 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -109.65 -61.68 1.61 Allowed 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.764 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.735 ' HG ' HG22 ' B' ' 505' ' ' VAL . 48.1 mt -89.35 -21.16 23.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.151 -175.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -70.44 -10.18 66.02 Favored Glycine 0 C--N 1.329 0.162 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.452 -177.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 28.3 mtpp -79.9 -11.83 59.78 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 175.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.463 ' HB2' ' HB3' ' B' ' 515' ' ' LEU . 60.5 m-85 -124.95 104.33 30.0 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.054 -178.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -50.13 -50.45 13.36 Favored 'Trans proline' 0 CA--C 1.531 0.344 0 C-N-CA 123.523 2.815 . . . . 0.0 113.586 -175.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -66.51 -41.47 88.78 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.095 0.474 . . . . 0.0 110.665 -177.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.463 ' HB3' ' HB2' ' B' ' 512' ' ' PHE . 22.2 tp -67.0 -45.71 76.73 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.727 -175.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 24.4 t80 -67.28 -32.34 73.27 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.351 179.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -64.15 -47.49 79.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.463 177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.475 ' CH2' ' HA ' ' B' ' 464' ' ' GLU . 4.9 t90 -57.16 -48.56 78.4 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.753 179.431 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.516 ' CZ ' HD11 ' B' ' 523' ' ' LEU . 39.5 t80 -56.82 -50.69 71.63 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.495 -178.105 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -63.2 -38.29 90.57 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.2 -178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -64.43 -44.42 91.27 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.586 -179.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 71.6 t80 -63.03 -41.38 99.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.633 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.573 HD23 HG11 ' A' ' 204' ' ' VAL . 88.7 mt -71.08 -26.64 63.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.489 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.55 33.87 15.32 Favored Glycine 0 N--CA 1.444 -0.774 0 N-CA-C 110.907 -0.877 . . . . 0.0 110.907 -173.374 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -90.65 90.81 8.13 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -97.35 29.03 3.38 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.179 -179.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 67.62 18.51 9.91 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.145 -177.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . 0.413 ' C ' HH22 ' B' ' 498' ' ' ARG . 17.0 m . . . . . 0 C--O 1.247 0.966 0 CA-C-O 118.583 -0.722 . . . . 0.0 109.835 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 10.1 p . . . . . 0 N--CA 1.475 0.798 0 CA-C-O 120.877 0.37 . . . . 0.0 110.53 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -78.11 130.97 37.04 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.019 0.438 . . . . 0.0 110.479 -179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -158.3 143.31 16.41 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.33 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 92.12 -154.94 22.68 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.179 -178.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.0 p -91.05 155.31 18.77 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.734 0.302 . . . . 0.0 110.889 -179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -89.49 -58.25 2.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 121.113 0.482 . . . . 0.0 110.294 177.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -103.77 142.0 35.12 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.555 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -106.62 152.04 24.27 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.934 178.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 138.06 -46.56 0.98 Allowed Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.96 -0.638 . . . . 0.0 112.357 177.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 67.8 -97.09 0.4 Allowed Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.983 -0.627 . . . . 0.0 111.971 -178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -128.36 106.41 8.99 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 178.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 49.4 m -152.65 142.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.861 179.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 5.5 Cg_exo -76.94 170.93 18.89 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.605 2.203 . . . . 0.0 111.567 178.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 15.3 m -68.93 127.98 31.66 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.836 178.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 61.28 92.86 0.05 OUTLIER 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.349 0.595 . . . . 0.0 111.542 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.22 -20.25 27.2 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.154 -0.475 . . . . 0.0 109.97 178.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.435 HD13 ' HE2' ' B' ' 511' ' ' LYS . 4.2 pt -136.17 135.49 49.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.527 176.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.626 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.2 t70 -81.43 -64.19 1.24 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 172.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 63.1 m -151.42 96.24 3.24 Favored Pre-proline 0 N--CA 1.452 -0.344 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.303 178.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.525 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 53.7 Cg_exo -54.09 147.94 41.77 Favored 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.699 2.266 . . . . 0.0 112.131 175.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -126.64 149.72 49.34 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.122 0.487 . . . . 0.0 111.111 -175.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.626 HG21 HD21 ' B' ' 483' ' ' ASN . 0.8 OUTLIER -95.47 138.73 20.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.915 -175.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.46 -46.87 68.63 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-O 121.831 0.824 . . . . 0.0 109.787 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.583 HD23 HD22 ' B' ' 504' ' ' LEU . 40.2 mt 60.28 10.04 2.2 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 113.527 -1.67 . . . . 0.0 111.553 -176.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -94.03 -10.96 31.81 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.657 178.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 3.7 mp0 -70.39 -29.95 66.72 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 177.333 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.584 HD21 HD21 ' B' ' 504' ' ' LEU . 19.2 mt -59.31 131.62 51.55 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.219 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -72.29 163.61 27.67 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.657 -0.701 . . . . 0.0 109.914 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 54.7 t -56.54 -44.17 80.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 120.758 0.313 . . . . 0.0 110.744 -178.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 24.8 p30 -61.77 -35.43 78.12 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 48.1 m -71.78 -46.84 57.0 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.693 0.282 . . . . 0.0 110.97 178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.654 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 88.1 mt -60.84 -46.82 89.05 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 121.226 0.536 . . . . 0.0 110.46 179.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.462 ' HA ' ' HD3' ' A' ' 162' ' ' LYS . 29.5 mtp180 -65.12 -31.83 73.22 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.677 177.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 156' ' ' ASN . 39.3 ttm180 -67.24 -46.81 72.63 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.266 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 57.8 t80 -52.94 -49.76 65.36 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.025 0.44 . . . . 0.0 110.335 174.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.462 ' HD3' ' HA ' ' A' ' 159' ' ' ARG . 7.9 mtpm? -57.7 -45.35 85.83 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.881 -179.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.1 tpt180 -81.91 -31.7 31.27 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.514 -172.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.531 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 45.4 t-80 -72.57 -37.99 68.05 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.563 -0.29 . . . . 0.0 110.556 -179.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.5 m-85 -88.41 -8.07 55.6 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.239 179.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 49.0 mmtm 61.33 69.99 0.63 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.766 0.666 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.479 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 84.9 mt -105.93 145.15 30.34 Favored Pre-proline 0 C--N 1.325 -0.469 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.233 -178.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 21.5 Cg_exo -65.68 150.73 86.03 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.182 2.588 . . . . 0.0 111.928 176.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 18.7 p -136.55 167.4 21.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.092 0.473 . . . . 0.0 112.115 -175.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 46.1 mtm180 -121.18 151.9 56.32 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.462 176.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -66.45 134.41 35.74 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.231 1.954 . . . . 0.0 111.763 174.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 97.01 39.89 3.93 Favored Glycine 0 N--CA 1.449 -0.441 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.081 -178.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 85.6 mt -69.55 143.83 53.28 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.136 0.493 . . . . 0.0 111.314 -179.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.732 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 26.9 m-80 -141.66 177.34 8.22 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.589 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -56.78 -52.11 66.32 Favored 'General case' 0 C--N 1.329 -0.306 0 O-C-N 123.182 0.301 . . . . 0.0 111.262 -177.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -67.9 -30.03 69.27 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.736 0.303 . . . . 0.0 110.847 -179.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.732 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 25.4 mm-40 -64.58 -42.54 95.56 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.146 177.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.664 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 75.3 mt -62.72 -46.97 85.63 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.056 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . . . . . . . . . 91.8 t -57.79 -46.03 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.199 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.281 178.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -60.1 -46.2 90.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.45 -179.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 76.0 mt -64.2 -49.54 80.78 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-O 121.015 0.436 . . . . 0.0 110.417 178.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.503 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 72.6 t -59.13 -49.47 83.24 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.91 -179.558 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.9 -37.31 92.12 Favored Glycine 0 N--CA 1.448 -0.557 0 C-N-CA 121.49 -0.386 . . . . 0.0 112.835 -176.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 51.4 t -59.48 -48.97 79.61 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.748 0.309 . . . . 0.0 110.39 178.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -80.77 -26.14 37.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.034 -178.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.503 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.9 t80 -57.28 -48.59 78.52 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.71 -179.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -80.9 45.95 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.341 0.591 . . . . 0.0 111.417 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 61.7 m -152.02 11.38 0.56 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.196 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.792 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 79.1 mt -89.34 120.93 69.75 Favored Pre-proline 0 C--O 1.234 0.246 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.619 -178.483 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 8.1 Cg_exo -72.08 148.07 49.86 Favored 'Trans proline' 0 N--CA 1.462 -0.327 0 C-N-CA 122.836 2.357 . . . . 0.0 111.732 177.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -142.26 129.8 20.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 0.0 111.327 179.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.4 ' HB3' ' HB3' ' A' ' 195' ' ' ASP . 26.5 t-20 -91.44 119.63 31.58 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 169.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.549 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 42.4 tt0 -51.63 -54.17 30.72 Favored 'General case' 0 C--N 1.327 -0.375 0 O-C-N 123.388 0.43 . . . . 0.0 111.474 -173.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 55.1 tptt -59.24 -51.47 69.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.895 0.378 . . . . 0.0 111.202 -178.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . 0.4 ' HB3' ' HB3' ' A' ' 192' ' ' ASN . 38.4 t70 -62.85 -43.94 97.46 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.328 -176.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . 0.437 HG21 ' HB3' ' B' ' 485' ' ' LEU . 19.9 m -66.34 -42.69 87.77 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.299 -176.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.549 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 80.3 mt -62.98 -41.82 99.66 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.734 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 28.3 m -57.46 -46.23 83.87 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.375 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 95.0 m -56.87 -56.19 24.77 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.478 179.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.53 ' CG ' HD22 ' B' ' 488' ' ' LEU . 56.1 t80 -62.72 -55.5 26.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.603 -175.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 67.4 mt -56.43 -55.67 17.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.231 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -66.89 -34.82 78.62 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -173.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 50.1 m -64.99 -51.63 60.65 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.724 178.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.573 HG11 HD12 ' B' ' 523' ' ' LEU . 44.4 t -68.92 -28.72 40.73 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.22 0 CA-C-O 120.827 0.346 . . . . 0.0 110.827 -178.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -63.7 -21.11 66.23 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.986 0.422 . . . . 0.0 111.05 174.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 27.1 m-80 -106.14 -64.55 1.15 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.292 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 9.7 m-20 -143.29 137.19 28.68 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.158 -173.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.71 39.88 1.12 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.293 0.568 . . . . 0.0 109.599 175.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 18.6 m120 63.33 -96.9 0.06 Allowed 'General case' 0 C--N 1.334 -0.102 0 CA-C-N 114.717 -1.129 . . . . 0.0 111.007 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 17.5 pttm -155.21 19.85 0.42 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.464 0.65 . . . . 0.0 109.698 177.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . 0.418 ' HB2' ' HB3' ' B' ' 497' ' ' SER . 39.1 t -90.58 -8.57 49.86 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.271 -0.877 . . . . 0.0 109.876 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.647 ' HA ' ' NH2' ' B' ' 498' ' ' ARG . 6.9 p-10 -96.03 -5.73 40.38 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.035 -177.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 53.3 tp -70.8 129.46 39.16 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.556 -178.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -123.3 113.69 19.21 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.493 -176.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -95.26 -162.16 0.93 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.387 173.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -59.22 114.39 2.61 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 18.0 p -80.92 -33.74 33.91 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.241 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -177.67 -90.55 0.08 OUTLIER Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.401 -0.904 . . . . 0.0 112.698 179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 59.3 t 71.93 113.26 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.29 0 CA-C-O 121.417 0.627 . . . . 0.0 110.726 -176.283 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 82.3 m-70 . . . . . 0 C--O 1.241 0.644 0 CA-C-O 118.271 -0.871 . . . . 0.0 110.186 -176.002 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 110.245 -0.279 . . . . 0.0 110.245 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -77.29 -23.26 51.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.692 -0.231 . . . . 0.0 111.187 -178.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -61.75 -58.89 6.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.712 0.291 . . . . 0.0 110.561 176.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 20.2 m -92.12 76.94 5.34 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.132 176.174 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . 0.515 ' H ' ' HD3' ' B' ' 458' ' ' LYS . 0.3 OUTLIER -74.85 155.49 37.47 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.465 179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -100.27 162.54 12.89 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.834 0.35 . . . . 0.0 110.571 -176.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 162.28 178.86 36.51 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.9 -0.667 . . . . 0.0 111.9 179.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 29.1 m -122.64 162.39 22.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.597 0.237 . . . . 0.0 110.534 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 95.89 7.08 58.93 Favored Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.784 -0.722 . . . . 0.0 111.691 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 6.2 t -90.14 -19.57 24.12 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.634 0.254 . . . . 0.0 110.608 -178.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.473 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 1.6 pm0 -63.58 -38.66 91.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.833 0.349 . . . . 0.0 110.627 177.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 9.9 m -59.26 -43.71 92.44 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.244 177.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 8.1 tt -59.73 -48.42 81.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.896 177.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.489 ' O ' HG23 ' B' ' 471' ' ' VAL . 73.2 t80 -53.48 -52.9 58.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.06 178.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.467 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 65.0 m-85 -70.18 -28.93 65.7 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.021 0.378 . . . . 0.0 112.021 -174.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -68.21 -40.79 82.02 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 174.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 4.0 mptp? -57.95 -50.27 73.95 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.368 172.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.489 HG23 ' O ' ' B' ' 467' ' ' PHE . 84.1 t -54.51 -42.23 58.36 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.869 0.366 . . . . 0.0 110.976 178.325 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 7.1 mmt180 -54.93 -51.57 65.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.313 177.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 60.7 tttp -78.46 -33.23 48.53 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.834 -175.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.722 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -70.37 -45.84 65.26 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -174.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.0 mp -69.75 -30.67 68.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.679 -178.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.404 ' HG3' ' O ' ' B' ' 474' ' ' ALA . 13.3 mtp180 68.94 -51.95 0.58 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.683 0.793 . . . . 0.0 112.427 173.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.626 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 29.4 t -78.77 137.8 37.91 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.882 -178.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.58 -37.98 88.19 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.594 178.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -65.12 -38.77 91.72 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 179.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.525 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.16 -47.3 74.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.975 179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.467 ' CE2' HD11 ' B' ' 485' ' ' LEU . 91.3 t80 -65.62 -42.92 91.0 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.543 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.605 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 37.1 tt0 -59.43 -40.81 87.96 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.676 177.251 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.626 HD21 HG21 ' A' ' 148' ' ' VAL . 3.0 t30 -57.93 -47.61 82.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.686 178.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -51.73 -49.91 61.61 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.95 174.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.467 HD11 ' CE2' ' B' ' 481' ' ' TYR . 71.7 mt -63.05 -34.37 77.42 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.22 -179.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.792 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 24.2 mtt85 -66.52 -36.54 82.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.813 0.339 . . . . 0.0 110.54 177.624 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 51.4 m -61.44 -36.42 80.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.23 0.538 . . . . 0.0 109.657 174.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.53 HD22 ' CG ' ' A' ' 200' ' ' PHE . 61.9 mt -66.11 -47.74 73.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.569 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.576 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.5 m -65.77 -42.16 91.8 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.177 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 -176.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.474 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 22.7 pt -68.48 -31.39 51.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 C-N-CA 120.383 -0.527 . . . . 0.0 110.601 179.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.18 -42.02 99.3 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.291 0.567 . . . . 0.0 110.02 172.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -65.95 -31.36 72.23 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.759 -178.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . 0.576 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 77.1 mt-30 -90.39 15.03 11.36 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.552 -177.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 68.75 10.93 8.17 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.128 0.571 . . . . 0.0 112.226 177.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.474 ' HB ' ' HB ' ' B' ' 490' ' ' ILE . 90.0 t -68.85 -55.51 15.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.089 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.419 HG12 HG13 ' B' ' 490' ' ' ILE . 42.3 pt -111.83 152.45 13.7 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.436 ' HB2' ' OE1' ' B' ' 500' ' ' GLU . 58.2 m -102.5 -177.28 3.35 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 121.058 -0.257 . . . . 0.0 110.784 177.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.647 ' NH2' ' HA ' ' A' ' 212' ' ' ASP . 40.2 ttp180 -57.25 -45.94 83.5 Favored 'General case' 0 C--O 1.225 -0.194 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.643 -175.406 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -58.89 -51.03 71.79 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.776 0.322 . . . . 0.0 111.036 -178.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.568 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.7 mp0 -60.21 -44.33 95.25 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.84 179.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 65.8 tp -56.47 -46.85 80.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.067 0.461 . . . . 0.0 110.955 179.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.574 HG23 ' O ' ' B' ' 498' ' ' ARG . 88.5 t -63.1 -35.91 73.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.883 -179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -77.56 -30.02 52.48 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.92 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.584 HD21 HD21 ' A' ' 153' ' ' LEU . 86.2 mt -71.21 -39.72 71.58 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -177.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.2 p -84.29 7.1 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 CA-C-O 121.255 0.55 . . . . 0.0 110.864 -177.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.641 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 31.7 t -57.95 -52.75 72.16 Favored Pre-proline 0 CA--C 1.542 0.664 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.721 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.641 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.0 Cg_exo -66.67 -3.39 9.16 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.286 1.991 . . . . 0.0 112.931 178.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.583 ' CZ ' HG22 ' A' ' 148' ' ' VAL . 95.8 m-85 -109.27 -53.78 2.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.35 -0.387 . . . . 0.0 111.425 -175.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.586 HD22 HD23 ' B' ' 515' ' ' LEU . 87.1 mt -107.1 -6.42 17.41 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.679 0.251 . . . . 0.0 111.679 -176.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.03 -15.61 69.71 Favored Glycine 0 CA--C 1.517 0.171 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.006 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.44 ' HG3' ' CE2' ' B' ' 512' ' ' PHE . 0.0 OUTLIER -84.75 1.97 44.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.026 0.441 . . . . 0.0 110.523 177.138 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.722 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 87.9 m-85 -128.54 93.33 38.29 Favored Pre-proline 0 C--N 1.332 -0.163 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.853 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 10.0 Cg_endo -52.55 -54.08 5.78 Favored 'Trans proline' 0 CA--C 1.528 0.198 0 C-N-CA 123.537 2.825 . . . . 0.0 113.345 -173.74 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -66.94 -33.26 75.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 0.0 111.207 -176.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.586 HD23 HD22 ' B' ' 509' ' ' LEU . 16.3 tp -74.84 -39.16 61.76 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.183 0.516 . . . . 0.0 110.26 -178.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 19.1 t80 -70.15 -30.31 67.43 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 176.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 36.2 t30 -61.31 -45.19 95.46 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.851 173.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.473 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 19.0 t90 -56.23 -48.41 76.54 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.744 176.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.55 -47.04 76.99 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.537 -179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -61.2 -39.82 91.65 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.98 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -66.46 -37.36 84.97 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.047 -179.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -71.86 -35.12 69.73 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.112 0.482 . . . . 0.0 110.395 -177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.573 HD12 HG11 ' A' ' 204' ' ' VAL . 5.2 mp -86.92 -7.15 58.45 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.492 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.72 40.27 97.84 Favored Glycine 0 N--CA 1.452 -0.248 0 N-CA-C 111.186 -0.766 . . . . 0.0 111.186 -175.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 45.5 t80 -79.08 96.02 5.7 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.1 0.476 . . . . 0.0 110.675 -173.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 86.3 mttt -84.27 144.32 28.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.021 179.766 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -92.68 -1.14 57.09 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.38 0.61 . . . . 0.0 110.608 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 18.6 m . . . . . 0 C--O 1.25 1.111 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.527 -178.094 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 N--CA 1.476 0.862 0 CA-C-O 120.832 0.349 . . . . 0.0 110.65 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 26.4 p-10 -78.15 -21.36 50.39 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.342 175.35 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . 69.98 -61.23 0.46 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 123.488 0.715 . . . . 0.0 111.473 -178.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 83.36 26.39 43.7 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 120.914 -0.66 . . . . 0.0 111.494 -177.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 43.2 t -146.12 149.16 33.5 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 20.0 t70 67.95 75.69 0.28 Allowed 'General case' 0 C--N 1.33 -0.257 0 O-C-N 124.247 0.967 . . . . 0.0 111.098 179.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -114.64 -25.34 8.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.052 173.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -85.37 174.58 9.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.864 177.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 112.87 -145.76 18.25 Favored Glycine 0 N--CA 1.442 -0.942 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.435 176.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 92.09 -87.51 1.29 Allowed Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.385 -176.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.401 ' HB3' ' H ' ' A' ' 138' ' ' SER . 4.3 m-20 57.77 -155.07 0.34 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 110.183 -0.303 . . . . 0.0 110.183 -178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.401 ' H ' ' HB3' ' A' ' 137' ' ' ASP . 19.9 m 71.01 130.7 0.04 OUTLIER Pre-proline 0 CA--C 1.531 0.235 0 C-N-CA 123.086 0.554 . . . . 0.0 110.902 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_exo -45.65 -71.12 0.06 OUTLIER 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.197 2.598 . . . . 0.0 112.877 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 21.7 t 45.44 76.31 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-O 121.577 0.703 . . . . 0.0 111.452 178.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -94.84 133.96 37.99 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.236 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.518 ' O ' HG23 ' A' ' 143' ' ' ILE . 7.7 m-20 52.87 -108.91 0.44 Allowed 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 123.819 0.699 . . . . 0.0 109.474 -177.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.518 HG23 ' O ' ' A' ' 142' ' ' ASP . 1.4 pt -163.37 120.75 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 O-C-N 123.498 0.499 . . . . 0.0 110.729 175.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.559 ' HA ' ' NH1' ' B' ' 476' ' ' ARG . 31.3 t70 -78.4 -51.56 9.87 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 176.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 86.8 m -157.92 103.11 1.76 Allowed Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.207 175.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.589 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 4.5 Cg_exo -74.29 165.22 32.34 Favored 'Trans proline' 0 N--CA 1.461 -0.441 0 C-N-CA 122.628 2.218 . . . . 0.0 111.394 174.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -120.66 152.62 37.96 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.958 -177.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.5 p -100.17 124.83 53.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-O 121.136 0.493 . . . . 0.0 110.957 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -81.65 107.06 14.09 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.156 -0.475 . . . . 0.0 109.772 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 81.5 mt -91.96 5.27 50.71 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.831 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 75.1 t80 -80.47 -17.44 51.67 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 178.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -64.68 -27.42 68.91 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.619 175.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.536 HD21 HD11 ' B' ' 504' ' ' LEU . 52.1 mt -69.98 142.69 52.8 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.586 -0.734 . . . . 0.0 111.036 -176.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -70.5 158.14 36.61 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.073 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 97.5 t -58.29 -43.1 85.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.028 0.442 . . . . 0.0 110.145 177.24 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.99 -40.05 91.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.824 -0.625 . . . . 0.0 110.344 178.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 16.6 m -65.89 -42.8 89.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.107 -179.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 91.8 mt -65.06 -42.01 94.62 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.978 0.418 . . . . 0.0 110.814 178.151 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -64.42 -35.93 82.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.977 175.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.571 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 23.7 ttm180 -63.66 -39.94 95.58 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.085 -179.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.465 ' HA ' HG13 ' B' ' 495' ' ' VAL . 54.3 t80 -60.51 -52.27 65.92 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.544 173.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.636 ' HG2' HD12 ' A' ' 167' ' ' LEU . 19.9 mtpp -66.35 -28.69 68.85 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.502 -0.772 . . . . 0.0 112.069 -175.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 66.4 ttt180 -80.04 -39.52 29.67 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.648 -0.251 . . . . 0.0 111.092 178.188 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 1.8 m80 -70.64 -40.67 72.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.597 0.237 . . . . 0.0 111.232 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -88.6 -0.4 57.22 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.914 -0.314 . . . . 0.0 111.493 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt 55.99 82.37 0.11 Allowed 'General case' 0 C--O 1.236 0.346 0 O-C-N 123.677 0.61 . . . . 0.0 111.922 176.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.636 HD12 ' HG2' ' A' ' 162' ' ' LYS . 93.2 mt -114.53 134.1 22.4 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.478 179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -79.61 127.81 7.43 Favored 'Trans proline' 0 N--CA 1.459 -0.553 0 C-N-CA 122.527 2.152 . . . . 0.0 112.254 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 10.6 t -173.38 158.29 3.49 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.258 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.405 ' HD2' ' C ' ' A' ' 170' ' ' ARG . 7.5 ppt_? -83.13 153.98 66.72 Favored Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 110.271 -0.27 . . . . 0.0 110.271 179.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -71.92 157.44 54.8 Favored 'Trans proline' 0 C--O 1.235 0.336 0 C-N-CA 122.511 2.14 . . . . 0.0 112.658 -178.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 92.05 25.84 20.84 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.663 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 64.2 mt -73.68 144.23 45.9 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 178.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.981 ' HB2' ' HG2' ' A' ' 177' ' ' GLN . 16.7 m120 -80.21 168.21 19.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.493 -0.321 . . . . 0.0 110.773 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.668 ' O ' HG23 ' A' ' 179' ' ' VAL . 17.8 tptm -55.88 -54.52 43.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.519 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -61.77 -33.02 73.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.779 0.323 . . . . 0.0 111.323 -179.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.981 ' HG2' ' HB2' ' A' ' 174' ' ' ASN . 5.8 mm100 -69.22 -40.85 77.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.013 -178.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.493 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 94.5 mt -59.83 -44.66 93.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.009 -0.541 . . . . 0.0 109.883 175.281 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 175' ' ' LYS . 37.6 t -57.67 -43.05 82.88 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.067 -178.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -63.03 -48.43 78.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.1 179.239 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.8 mt -61.93 -46.27 96.87 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 CA-C-O 120.947 0.403 . . . . 0.0 110.687 179.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.413 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.7 t -59.39 -48.6 86.57 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.368 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.409 178.104 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -58.82 -46.76 93.05 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 121.376 -0.44 . . . . 0.0 112.714 -179.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.98 -45.64 78.9 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.928 0.394 . . . . 0.0 111.231 179.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 -79.48 -29.96 41.88 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.923 -178.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 28.0 t80 -63.47 -43.47 97.25 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.787 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -68.07 -15.58 63.65 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.944 0.402 . . . . 0.0 111.198 178.301 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 30.3 m -99.33 10.18 41.91 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.566 -176.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 69.2 mt -83.26 118.98 73.23 Favored Pre-proline 0 C--O 1.234 0.271 0 CA-C-O 120.651 0.262 . . . . 0.0 111.185 179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -78.09 114.2 3.54 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.104 2.536 . . . . 0.0 110.925 173.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.03 138.28 52.81 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-O 121.128 0.49 . . . . 0.0 111.241 -174.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 87.7 m-20 -100.28 142.15 32.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.855 178.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.69 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 34.7 tt0 -63.59 -64.32 0.93 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -175.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . 0.404 ' C ' ' HD3' ' A' ' 194' ' ' LYS . 1.0 OUTLIER -64.43 -50.08 68.95 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.19 -171.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -55.62 -39.75 71.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.468 -176.219 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 37.1 m -75.3 -36.81 61.07 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.072 -177.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.69 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 21.8 mt -60.29 -48.13 83.04 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 176.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 63.6 m -59.19 -42.67 91.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.802 178.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 68.5 m -56.54 -55.79 29.41 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 121.187 0.518 . . . . 0.0 111.696 177.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.722 ' HD2' ' HZ ' ' B' ' 468' ' ' PHE . 46.6 t80 -63.44 -48.03 79.42 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.109 -176.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . . . . . . . . . 82.6 mt -57.61 -52.82 52.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 -177.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -58.59 -37.67 76.31 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 -178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 33.1 m -60.66 -52.26 65.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.884 0.373 . . . . 0.0 110.74 179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.608 ' HA ' ' O ' ' A' ' 207' ' ' ASP . 18.9 t -76.54 -24.5 15.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.915 -174.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.454 ' HD3' HG21 ' B' ' 461' ' ' VAL . 0.4 OUTLIER -67.63 -21.56 65.38 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.968 0.413 . . . . 0.0 110.978 177.788 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -105.54 -47.35 3.94 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.839 0.352 . . . . 0.0 111.027 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.608 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 3.8 p30 -150.69 -156.15 0.69 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.817 -177.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -133.82 16.08 3.93 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -177.92 95.21 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 O-C-N 123.421 0.451 . . . . 0.0 110.347 178.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.457 ' NZ ' ' HB3' ' A' ' 210' ' ' LYS . 5.1 ttpm? -165.72 144.77 6.22 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.028 -179.346 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 2.9 p -82.18 172.96 12.58 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.12 175.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -77.67 92.62 4.14 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.32 0.581 . . . . 0.0 110.747 -178.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 4.3 pp -146.4 148.69 32.57 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.122 178.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 11.2 mptt -123.02 41.99 3.32 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.191 0.519 . . . . 0.0 110.098 178.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -82.53 12.83 4.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.328 -179.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 3.1 t70 -86.39 116.57 24.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.077 0.465 . . . . 0.0 111.034 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 69.3 m -124.39 20.81 8.76 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.001 176.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 134.79 155.97 7.6 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.322 179.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 27.2 m -62.1 142.6 16.22 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 121.055 0.455 . . . . 0.0 110.959 179.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 40.0 m80 . . . . . 0 C--O 1.245 0.864 0 CA-C-O 118.473 -0.775 . . . . 0.0 109.99 -177.445 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 120.486 0.184 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -148.19 159.22 44.18 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 -178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -68.77 177.38 2.56 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.122 0.486 . . . . 0.0 111.976 -177.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 13.2 t -78.92 174.24 11.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.998 -0.547 . . . . 0.0 110.146 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -124.37 166.37 16.08 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.543 -175.772 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -110.87 15.35 21.88 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.21 0.528 . . . . 0.0 110.354 -179.577 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -148.0 -172.46 18.03 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.67 -0.696 . . . . 0.0 111.583 178.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . 0.454 HG21 ' HD3' ' A' ' 205' ' ' ARG . 61.3 t -84.74 -48.18 16.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 120.845 0.355 . . . . 0.0 110.415 178.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -158.46 -95.99 0.11 Allowed Glycine 0 N--CA 1.445 -0.738 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.65 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 2.8 p -90.32 -4.29 57.21 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -171.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -61.17 -40.33 93.51 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 118.098 0.408 . . . . 0.0 111.063 179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 68.4 m -63.12 -34.05 76.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.906 0.384 . . . . 0.0 110.486 176.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 55.7 tp -67.64 -47.45 69.53 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.392 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.583 ' O ' HG23 ' B' ' 471' ' ' VAL . 74.9 t80 -52.59 -59.25 4.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.427 177.226 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.722 ' HZ ' ' HD2' ' A' ' 200' ' ' PHE . 58.6 m-85 -63.55 -39.37 94.24 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -174.189 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -64.79 -41.41 95.84 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.991 0.424 . . . . 0.0 110.186 177.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.2 -42.32 93.66 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.326 178.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.583 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.9 t -60.67 -51.35 74.16 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-O 120.955 0.407 . . . . 0.0 110.204 175.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 51.8 ttp180 -55.04 -34.85 63.88 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.454 -177.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -87.06 -51.03 6.24 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.818 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -71.39 -25.54 62.4 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -172.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . 0.436 HD12 ' HA ' ' B' ' 475' ' ' LEU . 12.1 tp -70.44 -19.76 62.95 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 110.05 -0.352 . . . . 0.0 110.05 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.559 ' NH1' ' HA ' ' A' ' 144' ' ' ASP . 2.4 tmt_? 73.59 -43.39 0.55 Allowed 'General case' 0 N--CA 1.469 0.498 0 O-C-N 124.071 0.857 . . . . 0.0 111.497 173.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.441 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 26.1 t -97.99 125.15 42.79 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 120.939 0.399 . . . . 0.0 111.273 -177.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -70.76 -27.8 64.2 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.806 174.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . 0.472 ' CD ' ' H ' ' B' ' 479' ' ' GLU . 2.6 mp0 -65.16 -44.24 89.2 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.604 176.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.589 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -65.25 -40.0 93.41 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.599 177.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.492 ' HE2' ' HG3' ' A' ' 193' ' ' GLU . 60.0 t80 -63.67 -37.8 88.7 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.842 176.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.458 ' HG2' ' HE ' ' B' ' 486' ' ' ARG . 27.5 tt0 -58.57 -44.21 89.65 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.251 174.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -63.45 -40.95 98.52 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.699 -179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 62.2 t80 -57.65 -47.56 81.91 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.31 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.443 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 83.3 mt -66.07 -30.55 71.09 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.028 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.624 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 19.9 mtm105 -68.92 -38.31 79.46 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.804 0.335 . . . . 0.0 110.793 176.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 55.8 m -60.74 -34.09 73.9 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.195 0.521 . . . . 0.0 109.857 171.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.543 HD22 ' CD1' ' A' ' 200' ' ' PHE . 31.8 mt -69.11 -45.62 69.75 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.917 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.545 HG22 ' HA ' ' B' ' 486' ' ' ARG . 24.3 m -62.9 -44.6 99.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.102 -179.085 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.498 ' HB ' ' HB ' ' B' ' 495' ' ' VAL . 43.6 pt -67.1 -30.46 49.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.941 179.186 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -62.27 -45.09 94.84 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 121.185 0.517 . . . . 0.0 110.31 174.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -73.33 -29.23 62.54 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.079 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -81.6 12.77 3.53 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.393 -0.367 . . . . 0.0 111.448 179.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 64.52 27.58 13.41 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.032 0.444 . . . . 0.0 111.148 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.571 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.6 t -87.66 -46.85 15.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.653 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 48.0 pt -120.02 160.96 19.98 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 CA-C-N 116.532 -0.304 . . . . 0.0 110.231 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.405 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.8 t -100.77 178.44 4.7 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.104 177.853 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.595 ' HD2' ' HB3' ' B' ' 523' ' ' LEU . 35.1 ttp180 -54.44 -52.39 61.97 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.979 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -50.97 -52.91 37.88 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.95 -1.023 . . . . 0.0 111.66 -178.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.449 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 2.2 mp0 -58.29 -47.41 83.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 110.999 178.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 66.6 tp -55.29 -45.64 76.21 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.071 -179.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.562 ' HA ' ' HE2' ' B' ' 519' ' ' PHE . 58.2 t -63.52 -38.54 82.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.965 -179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -74.99 -38.22 61.67 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.685 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.536 HD11 HD21 ' A' ' 153' ' ' LEU . 90.1 mt -62.33 -37.16 84.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-O 120.785 0.326 . . . . 0.0 111.813 -176.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.454 HG22 ' HG ' ' B' ' 509' ' ' LEU . 9.3 p -88.78 2.77 6.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.03 0.443 . . . . 0.0 111.183 -177.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.539 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 28.2 t -59.07 -49.23 94.27 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.084 -179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.539 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 51.5 Cg_exo -55.91 -23.93 45.28 Favored 'Trans proline' 0 C--N 1.358 1.044 0 C-N-CA 121.785 1.657 . . . . 0.0 112.571 176.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -87.88 -64.57 1.13 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.029 -177.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.668 HD22 HD23 ' B' ' 515' ' ' LEU . 64.7 mt -89.47 3.07 53.55 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.785 -172.563 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -63.43 -27.46 70.84 Favored Glycine 0 N--CA 1.453 -0.174 0 C-N-CA 121.082 -0.58 . . . . 0.0 112.488 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -87.02 1.35 53.15 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.754 0.311 . . . . 0.0 110.801 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -125.3 85.5 58.27 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-N 116.201 -0.454 . . . . 0.0 109.971 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.19 -54.88 3.99 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 123.154 2.569 . . . . 0.0 113.56 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -62.88 -31.88 73.02 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.831 0.348 . . . . 0.0 111.376 -176.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.668 HD23 HD22 ' B' ' 509' ' ' LEU . 20.9 tp -76.67 -42.04 43.31 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.281 0.562 . . . . 0.0 110.218 -177.12 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.441 ' HD1' ' HB2' ' B' ' 509' ' ' LEU . 32.1 t80 -70.97 -34.37 71.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.092 179.156 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -71.58 -30.51 65.93 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.724 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 8.5 t90 -61.44 -48.1 82.68 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 173.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.562 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 34.6 t80 -54.96 -43.24 73.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.357 177.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.422 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 97.3 mttt -62.52 -46.46 88.32 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.109 177.545 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 47.5 t-20 -60.36 -42.17 95.2 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.756 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -66.7 -41.21 88.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.463 -176.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.595 ' HB3' ' HD2' ' B' ' 498' ' ' ARG . 9.5 mp -82.75 -4.6 58.15 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.667 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 63.88 37.18 94.28 Favored Glycine 0 C--N 1.329 0.156 0 C-N-CA 120.684 -0.77 . . . . 0.0 111.261 -175.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -88.87 112.31 23.11 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 115.289 -0.456 . . . . 0.0 110.084 -175.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 55.2 pttt -125.32 125.25 43.21 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.58 179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 -81.63 70.69 8.57 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.204 177.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.247 0.937 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.118 -179.14 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 11.1 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.844 0.354 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -73.8 163.95 27.28 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.815 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -74.41 -33.18 62.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.084 -176.924 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 93.49 -53.71 2.39 Favored Glycine 0 N--CA 1.446 -0.68 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.004 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 25.1 m 62.64 -171.0 0.17 Allowed 'General case' 0 C--O 1.235 0.302 0 C-N-CA 122.645 0.378 . . . . 0.0 110.595 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -144.73 -60.33 0.37 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 178.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -76.83 -53.83 7.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.926 175.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 21.9 t70 67.55 -70.87 0.11 Allowed 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.543 -0.753 . . . . 0.0 111.461 -178.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -91.09 -59.05 1.42 Allowed Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.915 -0.66 . . . . 0.0 111.78 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 119.33 155.11 9.69 Favored Glycine 0 N--CA 1.448 -0.518 0 C-N-CA 121.004 -0.617 . . . . 0.0 112.329 177.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -110.81 153.8 24.86 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 179.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 43.7 m -122.54 98.33 43.63 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-O 120.699 0.285 . . . . 0.0 110.722 179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -79.06 -19.45 10.72 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.961 2.44 . . . . 0.0 112.184 179.453 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 98.7 t -122.83 122.15 65.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.58 -178.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -88.43 89.18 7.88 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.972 0.415 . . . . 0.0 110.212 174.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.412 ' HB2' HH12 ' B' ' 476' ' ' ARG . 10.8 p-10 -86.64 -26.36 24.4 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.763 177.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 36.7 mt 71.99 141.46 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.441 176.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -102.19 -55.41 2.48 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.679 -0.692 . . . . 0.0 109.236 176.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.5 m -161.06 107.12 1.26 Allowed Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.925 177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.426 ' HG2' ' CE2' ' B' ' 508' ' ' PHE . 45.0 Cg_endo -73.49 155.39 50.4 Favored 'Trans proline' 0 N--CA 1.458 -0.607 0 C-N-CA 121.893 1.729 . . . . 0.0 110.845 174.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -129.58 157.4 42.16 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 120.903 0.382 . . . . 0.0 111.246 -173.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.405 HG11 ' CE2' ' A' ' 186' ' ' PHE . 4.1 p -97.42 125.11 50.6 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.726 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.416 ' C ' ' H ' ' A' ' 151' ' ' TYR . 18.4 p-10 -94.43 96.62 9.63 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-O 121.344 0.593 . . . . 0.0 109.756 176.462 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.689 HD23 HD11 ' B' ' 504' ' ' LEU . 92.6 mt -71.48 25.27 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 112.817 0.673 . . . . 0.0 112.817 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.435 ' CD1' HG21 ' A' ' 179' ' ' VAL . 3.3 t80 -96.57 -4.81 40.57 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 120.958 0.409 . . . . 0.0 109.994 -178.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -84.65 -24.14 29.17 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 177.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.715 HD21 HD13 ' B' ' 504' ' ' LEU . 79.4 mt -62.63 135.52 57.42 Favored 'General case' 0 CA--C 1.518 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.231 177.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -74.98 163.26 27.81 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.405 177.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.91 -35.73 41.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -60.49 -44.89 95.49 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.767 -179.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.449 HG23 ' HA ' ' B' ' 496' ' ' ILE . 8.4 m -69.65 -42.41 74.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.085 -178.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 84.8 mt -61.25 -43.46 98.85 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.394 179.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -66.17 -34.86 78.99 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.74 176.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.673 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 34.7 ttm180 -68.16 -45.75 72.65 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.14 -178.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.41 ' HA ' ' CG1' ' B' ' 495' ' ' VAL . 48.4 t80 -52.89 -51.6 60.57 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.662 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.474 ' HZ3' ' HB3' ' A' ' 162' ' ' LYS . 10.2 mtpm? -59.95 -38.83 83.57 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.024 -178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 21.1 ttt180 -76.66 -44.97 31.67 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.728 -0.215 . . . . 0.0 111.242 -177.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.6 t60 -70.04 -30.9 68.29 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.601 0.238 . . . . 0.0 111.002 -176.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.528 ' CZ ' HG22 ' B' ' 490' ' ' ILE . 62.6 m-85 -96.15 0.3 51.08 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.841 -0.344 . . . . 0.0 111.185 179.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 55.61 75.22 0.34 Allowed 'General case' 0 N--CA 1.465 0.295 0 O-C-N 123.741 0.651 . . . . 0.0 111.846 178.271 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 89.2 mt -110.18 106.82 58.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.906 177.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 32.0 Cg_endo -65.26 125.7 15.01 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.347 2.031 . . . . 0.0 111.784 -178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.525 HG21 HD13 ' A' ' 181' ' ' ILE . 20.3 p -141.95 148.07 38.04 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.98 -175.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 7.0 ppt_? -90.25 156.71 45.91 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.6 -179.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -60.11 143.97 99.51 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 122.812 2.341 . . . . 0.0 112.656 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 110.6 31.41 2.99 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 120.894 -0.67 . . . . 0.0 111.756 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 93.9 mt -82.14 161.22 22.9 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.138 0.494 . . . . 0.0 111.06 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.783 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 16.3 t-20 -145.3 169.08 18.95 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 -175.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.47 ' HE3' ' O ' ' A' ' 153' ' ' LEU . 22.3 tptm -50.66 -49.64 56.64 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.751 0.31 . . . . 0.0 110.4 176.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . 0.523 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -63.24 -40.43 97.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.119 179.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.783 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 62.3 mm-40 -62.57 -46.92 86.13 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.041 0.448 . . . . 0.0 110.551 -179.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.693 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 83.1 mt -61.21 -43.22 99.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.537 -178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.435 HG21 ' CD1' ' A' ' 151' ' ' TYR . 57.1 t -60.37 -43.34 93.61 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.221 178.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.9 mt-10 -64.18 -41.75 96.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.906 0.384 . . . . 0.0 110.954 179.394 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.525 HD13 HG21 ' A' ' 169' ' ' THR . 81.3 mt -68.65 -50.88 51.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.535 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.822 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.554 HG12 HD13 ' A' ' 150' ' ' LEU . 77.9 t -58.44 -45.69 89.79 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.352 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.082 177.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . 0.457 ' O ' ' HG2' ' A' ' 187' ' ' LYS . . . -62.2 -42.05 99.72 Favored Glycine 0 N--CA 1.446 -0.653 0 CA-C-N 116.06 -0.518 . . . . 0.0 112.733 -178.464 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 47.8 t -60.72 -45.55 93.78 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 120.83 0.348 . . . . 0.0 110.555 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -77.24 -29.92 54.25 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.81 0.338 . . . . 0.0 110.704 179.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.405 ' CE2' HG11 ' A' ' 148' ' ' VAL . 45.2 t80 -63.07 -30.64 71.76 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.635 179.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.457 ' HG2' ' O ' ' A' ' 183' ' ' GLY . 72.8 mmtt -67.67 -12.51 60.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.659 178.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 17.0 m -133.87 59.62 1.73 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.067 0.46 . . . . 0.0 111.252 -176.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.802 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 67.8 mt -105.79 119.14 53.43 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.782 176.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -68.94 126.86 14.39 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.869 2.379 . . . . 0.0 111.17 175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.536 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.8 p -142.15 131.4 22.86 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 121.103 0.478 . . . . 0.0 111.537 -175.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -109.36 125.44 52.37 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.251 -0.431 . . . . 0.0 109.938 177.268 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.525 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.6 tt0 -49.32 -62.13 1.71 Allowed 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.761 0.652 . . . . 0.0 112.761 -172.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . 0.42 ' HE2' ' HB3' ' A' ' 194' ' ' LYS . 38.0 ttpt -55.89 -60.25 3.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -175.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -52.54 -42.01 64.02 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.115 0.483 . . . . 0.0 111.376 -177.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 56.9 m -68.72 -41.05 79.6 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.188 -176.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 60.5 mt -66.11 -48.7 70.01 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.341 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 30.1 m -56.34 -46.49 79.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.755 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . 0.575 ' HA ' ' CE2' ' A' ' 202' ' ' TYR . 71.2 m -62.2 -48.85 78.2 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.246 -179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.585 ' CD1' HD22 ' B' ' 488' ' ' LEU . 82.6 t80 -60.38 -49.29 78.19 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.861 0.362 . . . . 0.0 110.633 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.49 HD11 ' HE2' ' B' ' 468' ' ' PHE . 61.9 mt -58.0 -52.17 61.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.769 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . 0.575 ' CE2' ' HA ' ' A' ' 199' ' ' CYS . 2.2 p90 -69.45 -35.3 75.51 Favored 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 120.161 -0.616 . . . . 0.0 110.915 -174.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 44.8 m -64.93 -50.99 64.29 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.755 0.312 . . . . 0.0 110.629 -179.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.426 HG21 ' CE1' ' A' ' 200' ' ' PHE . 47.0 t -69.58 -25.58 29.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.929 -176.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.459 ' HD3' HG22 ' A' ' 201' ' ' ILE . 33.6 mtp180 -73.32 -22.04 60.42 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.775 0.321 . . . . 0.0 111.338 175.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -97.47 -72.97 0.62 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.651 -0.249 . . . . 0.0 110.543 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.636 ' HB2' ' HE3' ' A' ' 210' ' ' LYS . 9.9 m-20 -140.29 124.99 18.12 Favored 'General case' 0 CA--C 1.513 -0.458 0 N-CA-C 109.948 -0.39 . . . . 0.0 109.948 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.403 ' O ' ' HB3' ' A' ' 209' ' ' ASN . 0.0 OUTLIER -88.81 90.32 8.36 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.55 -175.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . 0.553 ' OD1' ' HA ' ' B' ' 497' ' ' SER . 10.4 t30 72.37 114.99 0.05 Allowed 'General case' 0 N--CA 1.472 0.627 0 O-C-N 123.819 0.699 . . . . 0.0 111.873 175.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . 0.636 ' HE3' ' HB2' ' A' ' 207' ' ' ASP . 44.4 mttp -112.51 18.99 17.96 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.122 -177.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 60.1 p -73.97 -53.83 9.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.94 0.4 . . . . 0.0 111.351 -176.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -106.55 19.81 19.94 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.276 -178.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 52.9 tp -61.65 -46.71 88.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.705 -178.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 58.1 mttp 63.8 -178.66 0.16 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.855 -0.612 . . . . 0.0 111.255 178.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -134.69 173.58 11.52 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.192 177.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -76.72 133.33 39.53 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.306 179.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 13.9 m -78.65 -18.76 53.96 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.706 -178.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 113.32 12.56 11.79 Favored Glycine 0 N--CA 1.448 -0.56 0 C-N-CA 120.862 -0.685 . . . . 0.0 112.654 176.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 45.3 t 74.53 -14.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 123.245 0.618 . . . . 0.0 111.18 178.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 16.8 t60 . . . . . 0 C--O 1.246 0.891 0 CA-C-O 118.619 -0.705 . . . . 0.0 110.016 -178.863 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 11.3 p . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 111.66 0.244 . . . . 0.0 111.66 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -104.79 -25.01 12.83 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.744 0.307 . . . . 0.0 111.16 -176.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -113.39 106.0 14.06 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.29 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 5.3 p -79.25 133.97 36.66 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.325 178.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 17.7 ptmt -163.9 99.7 0.87 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.22 0.533 . . . . 0.0 111.222 -176.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 14.1 t-80 -165.38 148.28 7.97 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.04 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -74.65 65.85 2.09 Favored Glycine 0 CA--C 1.518 0.278 0 C-N-CA 121.025 -0.607 . . . . 0.0 112.92 -178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 22.6 m -123.64 165.12 20.52 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-O 120.578 0.228 . . . . 0.0 110.586 179.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 154.01 -38.2 0.69 Allowed Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.108 -178.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 11.4 t -71.37 -26.22 62.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.692 0.282 . . . . 0.0 110.722 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.405 ' H ' ' CD ' ' B' ' 464' ' ' GLU . 32.0 mp0 -64.95 -48.08 75.36 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 176.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 3.6 m -63.19 -35.92 81.9 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 114.956 -1.02 . . . . 0.0 109.863 178.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 59.5 tp -60.41 -49.13 78.79 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.413 176.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.551 ' O ' HG23 ' B' ' 471' ' ' VAL . 65.0 t80 -53.43 -57.68 9.8 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.42 176.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.49 ' HE2' HD11 ' A' ' 201' ' ' ILE . 54.5 m-85 -62.52 -33.6 75.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.659 0.266 . . . . 0.0 111.508 -175.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -65.83 -44.76 84.59 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.231 176.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -67.73 -32.45 73.07 Favored 'General case' 0 C--O 1.223 -0.334 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.22 176.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.551 HG23 ' O ' ' B' ' 467' ' ' PHE . 76.2 t -59.85 -50.65 79.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 121.002 0.429 . . . . 0.0 109.935 174.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . 0.435 ' HG3' ' CE1' ' B' ' 481' ' ' TYR . 4.7 mtt-85 -56.28 -49.61 73.74 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.52 -0.763 . . . . 0.0 110.591 175.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 84.7 tttt -65.44 -41.38 93.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.89 -1.05 . . . . 0.0 112.049 -175.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -81.64 -40.7 22.52 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.456 0.539 . . . . 0.0 112.456 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -68.39 -39.08 81.83 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 121.144 -0.222 . . . . 0.0 110.99 -178.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.412 HH12 ' HB2' ' A' ' 142' ' ' ASP . 43.0 ttm180 71.03 -47.56 0.66 Allowed 'General case' 0 N--CA 1.472 0.634 0 O-C-N 123.72 0.637 . . . . 0.0 111.884 175.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 27.3 t -72.92 130.54 40.62 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.98 0.419 . . . . 0.0 110.535 179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.69 -31.0 69.79 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.814 -178.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -75.04 -34.28 61.84 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.896 179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' B' ' 483' ' ' ASN . . . -69.53 -42.49 74.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.057 0.456 . . . . 0.0 110.438 177.321 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.435 ' CE1' ' HG3' ' B' ' 472' ' ' ARG . 60.0 t80 -63.73 -40.49 96.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.066 175.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.721 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 30.2 tt0 -65.09 -38.16 89.84 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.87 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' B' ' 480' ' ' ALA . 13.9 t-20 -55.35 -47.6 75.51 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.829 0.347 . . . . 0.0 110.967 174.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.532 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 85.8 t80 -53.6 -44.39 69.37 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.773 -0.649 . . . . 0.0 109.937 176.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.536 ' HB3' HG21 ' A' ' 191' ' ' VAL . 83.1 mt -69.98 -28.96 65.96 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.383 179.279 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.802 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 21.6 mmt85 -63.2 -49.28 74.85 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.512 0.673 . . . . 0.0 109.335 174.549 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 57.6 m -57.8 -35.76 71.26 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.216 176.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.585 HD22 ' CD1' ' A' ' 200' ' ' PHE . 24.8 mt -65.79 -54.45 26.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.309 179.25 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.6 m -58.64 -42.53 85.2 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.745 -0.382 . . . . 0.0 111.92 -176.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.528 HG22 ' CZ ' ' A' ' 165' ' ' PHE . 20.8 pt -70.6 -31.32 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 C-N-CA 119.881 -0.728 . . . . 0.0 111.161 179.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -70.22 -37.54 75.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.951 0.405 . . . . 0.0 110.588 174.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -64.81 -30.44 71.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.265 0.555 . . . . 0.0 110.075 178.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -85.56 1.02 50.77 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.327 175.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 56.52 36.94 28.37 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.185 -177.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.673 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 94.8 t -78.6 -46.24 24.93 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.408 174.258 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.449 ' HA ' HG23 ' A' ' 157' ' ' THR . 39.8 pt -102.9 141.67 18.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.669 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.721 175.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.553 ' HA ' ' OD1' ' A' ' 209' ' ' ASN . 8.0 m -81.76 179.21 7.92 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.558 -178.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.577 ' O ' HG23 ' B' ' 502' ' ' VAL . 37.4 ttm180 -60.21 -57.87 10.97 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 116.823 -0.172 . . . . 0.0 110.629 -177.917 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -55.88 -38.96 70.87 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.018 179.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.548 ' HG2' ' HB2' ' B' ' 497' ' ' SER . 19.8 mm-40 -61.14 -49.97 75.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.521 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.488 ' HG ' ' HZ ' ' B' ' 519' ' ' PHE . 61.5 tp -59.35 -45.74 90.57 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.879 179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.577 HG23 ' O ' ' B' ' 498' ' ' ARG . 57.6 t -61.06 -40.7 86.56 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.186 -178.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -82.84 -22.41 34.11 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.619 -179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.715 HD13 HD21 ' A' ' 153' ' ' LEU . 11.5 tp -67.31 -49.88 62.41 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 121.332 0.587 . . . . 0.0 110.525 -178.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.55 HG22 ' HB2' ' B' ' 508' ' ' PHE . 9.8 p -86.18 13.05 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.311 -0.858 . . . . 0.0 110.55 -176.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.537 ' N ' ' HD2' ' B' ' 507' ' ' PRO . 22.8 t -57.19 -45.07 99.96 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -176.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.537 ' HD2' ' N ' ' B' ' 506' ' ' SER . 11.7 Cg_endo -59.24 -17.95 42.12 Favored 'Trans proline' 0 C--N 1.36 1.182 0 C-N-CA 122.287 1.991 . . . . 0.0 113.009 174.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.55 ' HB2' HG22 ' B' ' 505' ' ' VAL . 27.4 m-85 -105.71 149.12 26.69 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 108.982 -0.748 . . . . 0.0 108.982 178.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.422 HD22 HD23 ' B' ' 515' ' ' LEU . 71.9 mt 68.56 -17.73 0.18 Allowed 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 177.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' B' ' 508' ' ' PHE . . . -65.89 -15.03 61.89 Favored Glycine 0 C--N 1.334 0.453 0 C-N-CA 121.501 -0.381 . . . . 0.0 113.295 -176.411 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.451 ' H ' ' HD2' ' B' ' 511' ' ' LYS . 1.8 mptp? -85.09 -10.39 56.88 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.109 0.481 . . . . 0.0 109.779 177.161 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -123.2 92.96 48.61 Favored Pre-proline 0 C--O 1.235 0.334 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.95 -175.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_exo -51.05 -53.53 6.99 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 123.316 2.677 . . . . 0.0 113.564 -174.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -57.91 -37.42 74.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.883 0.373 . . . . 0.0 111.948 -176.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 509' ' ' LEU . 15.6 tp -79.48 -43.35 23.36 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.575 -171.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.465 ' O ' ' HG3' ' B' ' 520' ' ' LYS . 0.6 OUTLIER -70.88 -28.41 64.53 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 179.141 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -67.73 -42.99 81.01 Favored 'General case' 0 C--N 1.332 -0.164 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -53.32 -48.58 68.33 Favored 'General case' 0 CA--C 1.52 -0.185 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 177.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.488 ' HZ ' ' HG ' ' B' ' 501' ' ' LEU . 43.0 t80 -55.68 -52.41 63.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.137 179.004 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.465 ' HG3' ' O ' ' B' ' 516' ' ' PHE . 58.2 mttp -59.76 -40.39 88.03 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-O 120.94 0.4 . . . . 0.0 111.076 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -69.66 -32.78 71.63 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.534 -175.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.42 ' CZ ' ' HG3' ' A' ' 205' ' ' ARG . 54.5 t80 -82.41 -31.91 29.35 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.736 0.779 . . . . 0.0 108.972 -178.426 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.557 HD23 HG22 ' B' ' 502' ' ' VAL . 15.4 tp -81.76 -10.18 59.43 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.904 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 60.74 39.24 96.43 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 121.023 -0.608 . . . . 0.0 112.324 177.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 62.2 t80 -73.21 111.36 8.25 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 120.907 0.384 . . . . 0.0 110.552 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 5.9 mtpt -124.69 8.82 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . 0.551 ' OE2' ' HD2' ' B' ' 498' ' ' ARG . 1.8 mp0 -84.91 16.43 3.39 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.761 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.251 1.168 0 CA-C-O 118.7 -0.667 . . . . 0.0 110.309 179.652 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.477 0.9 0 CA-C-O 120.674 0.273 . . . . 0.0 111.154 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -150.04 -175.25 4.98 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 110.173 -0.306 . . . . 0.0 110.173 178.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -100.85 -42.54 6.41 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.08 0.467 . . . . 0.0 110.483 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -142.22 140.58 10.11 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.161 -179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 19.8 m -90.46 -2.38 57.93 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.392 0.615 . . . . 0.0 110.047 179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -85.21 88.14 7.45 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.234 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -80.63 -65.45 1.01 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.211 -177.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -96.26 -60.58 1.59 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.509 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -167.55 106.11 0.25 Allowed Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.612 -179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -109.29 148.26 17.02 Favored Glycine 0 N--CA 1.446 -0.657 0 C-N-CA 120.863 -0.684 . . . . 0.0 111.941 -179.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -92.69 -3.11 55.41 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.701 0.286 . . . . 0.0 110.506 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 62.1 p 46.9 78.68 0.38 Allowed Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.828 -176.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.02 132.59 8.53 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.9 2.4 . . . . 0.0 111.46 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 47.3 t 61.43 87.42 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.367 0.603 . . . . 0.0 111.251 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . 0.405 ' OE1' ' HE3' ' B' ' 511' ' ' LYS . 47.4 mt-30 -72.1 107.74 4.94 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 174.062 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -83.92 110.64 18.56 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.822 -174.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -149.2 112.29 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.754 -177.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -83.34 -52.74 6.29 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 25.8 m -151.79 97.35 3.07 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.2 -0.909 . . . . 0.0 109.505 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.609 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 52.6 Cg_exo -56.55 151.12 47.99 Favored 'Trans proline' 0 C--N 1.345 0.387 0 C-N-CA 122.761 2.307 . . . . 0.0 112.385 178.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -104.84 142.24 35.08 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.371 -176.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 3.1 p -101.97 106.22 19.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.412 0.625 . . . . 0.0 110.316 177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -65.56 114.04 4.62 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.93 177.733 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.438 ' HB2' HG13 ' A' ' 179' ' ' VAL . 77.8 mt -100.1 -0.11 39.65 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.243 0.544 . . . . 0.0 110.369 179.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 49.4 t80 -75.3 -20.84 58.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.183 -179.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.443 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 3.0 pt20 -70.29 -25.97 63.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.457 178.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.44 HD21 HD21 ' B' ' 504' ' ' LEU . 59.2 mt -68.29 161.29 27.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.327 0.584 . . . . 0.0 111.29 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -77.39 158.11 30.24 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.251 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.416 HG13 ' CD1' ' A' ' 178' ' ' LEU . 51.7 t -59.13 -44.77 92.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.159 0.504 . . . . 0.0 109.658 177.047 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.404 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 86.5 m-20 -62.09 -35.28 78.19 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.082 179.777 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 41.4 m -67.36 -45.82 75.17 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.842 0.353 . . . . 0.0 110.824 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 88.0 mt -65.98 -40.17 90.99 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-O 121.198 0.523 . . . . 0.0 110.802 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.504 ' O ' ' HG2' ' A' ' 163' ' ' ARG . 94.5 mtt180 -67.03 -37.24 83.77 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.347 175.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.522 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 39.8 ttm180 -61.46 -45.0 96.12 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.079 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 75.6 t80 -53.33 -50.28 65.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.615 -0.72 . . . . 0.0 110.091 173.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.472 ' HD3' ' CG2' ' A' ' 169' ' ' THR . 47.5 mttp -58.64 -45.49 89.19 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.774 -0.648 . . . . 0.0 112.144 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.504 ' HG2' ' O ' ' A' ' 159' ' ' ARG . 30.8 mmm180 -72.56 -39.29 67.56 Favored 'General case' 0 C--N 1.321 -0.659 0 C-N-CA 120.96 -0.296 . . . . 0.0 111.407 -175.462 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 15.8 m-70 -71.94 -33.72 68.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.729 0.299 . . . . 0.0 111.344 179.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.406 ' CE1' HG22 ' B' ' 490' ' ' ILE . 40.4 m-85 -93.29 3.11 56.18 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 121.048 -0.261 . . . . 0.0 111.421 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 70.5 mmtt 61.56 48.95 5.39 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.764 173.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.493 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 85.7 mt -92.55 134.09 28.51 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.134 -177.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.493 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 14.6 Cg_exo -69.39 127.32 14.71 Favored 'Trans proline' 0 C--O 1.235 0.37 0 C-N-CA 123.032 2.488 . . . . 0.0 111.808 176.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.56 ' HB ' HD11 ' A' ' 173' ' ' LEU . 16.6 p -115.76 132.03 56.76 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.056 0.455 . . . . 0.0 111.352 179.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -85.64 154.71 59.1 Favored Pre-proline 0 C--N 1.324 -0.512 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.244 177.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.49 137.67 56.22 Favored 'Trans proline' 0 C--O 1.235 0.328 0 C-N-CA 122.736 2.291 . . . . 0.0 111.743 177.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 100.69 39.85 3.07 Favored Glycine 0 N--CA 1.447 -0.606 0 C-N-CA 120.998 -0.62 . . . . 0.0 111.736 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.56 HD11 ' HB ' ' A' ' 169' ' ' THR . 85.8 mt -73.94 142.92 45.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.418 0.628 . . . . 0.0 111.634 -177.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.488 ' H ' ' HB2' ' A' ' 177' ' ' GLN . 11.1 t-20 -136.06 159.93 40.2 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.588 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.65 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.3 tptm -48.16 -54.31 13.78 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 123.289 0.368 . . . . 0.0 111.425 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . 0.476 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -61.1 -37.47 82.86 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.113 -178.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.488 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 15.1 mm100 -63.92 -40.96 97.7 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 121.377 0.608 . . . . 0.0 110.068 -179.387 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.476 ' O ' HG23 ' A' ' 182' ' ' VAL . 87.9 mt -61.16 -49.77 75.89 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.03 177.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.65 HG23 ' O ' ' A' ' 175' ' ' LYS . 19.0 t -56.92 -47.06 83.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 O-C-N 123.777 0.673 . . . . 0.0 111.034 -178.424 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.476 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 46.0 mt-10 -58.7 -50.11 75.1 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.548 -178.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 67.3 mt -61.96 -39.0 82.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 CA-C-O 120.858 0.361 . . . . 0.0 110.761 179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.606 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 71.9 t -64.02 -49.56 81.03 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.522 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.707 -178.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -66.43 -33.71 85.61 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 121.311 -0.471 . . . . 0.0 112.473 -179.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 52.9 t -59.03 -49.12 79.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.824 0.345 . . . . 0.0 110.298 177.654 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.7 t-80 -83.57 -23.53 31.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.056 -179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.606 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.3 t80 -58.54 -40.67 83.61 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 122.88 0.472 . . . . 0.0 110.67 -177.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.78 0.23 27.78 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.87 179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -107.25 13.77 26.83 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.809 0.338 . . . . 0.0 111.027 -179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.717 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 74.7 mt -90.89 116.61 66.79 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.605 -0.27 . . . . 0.0 110.899 -179.29 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -73.4 112.09 3.45 Favored 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.657 2.238 . . . . 0.0 111.345 175.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 10.0 p -120.11 137.2 54.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.952 -175.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -108.23 136.38 47.98 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.178 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -58.25 -61.87 2.25 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 24.2 tptm -55.98 -55.81 28.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.624 -176.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -54.09 -49.24 69.53 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.9 -179.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 38.9 m -69.32 -44.94 70.68 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -174.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.402 HD11 ' OH ' ' B' ' 481' ' ' TYR . 56.4 mt -60.12 -41.52 92.8 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.92 0.39 . . . . 0.0 110.129 178.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 54.4 m -58.93 -47.55 84.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.86 176.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 86.3 m -60.87 -45.97 92.44 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.092 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.575 ' CD1' HD22 ' B' ' 488' ' ' LEU . 65.6 t80 -61.43 -58.86 6.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.312 -178.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.533 HD11 ' HE2' ' B' ' 468' ' ' PHE . 67.8 mt -56.38 -43.41 77.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 121.025 0.441 . . . . 0.0 110.707 -175.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 33.9 t80 -62.52 -46.38 88.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.179 -177.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 21.3 m -68.71 -39.94 80.21 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.678 -175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.664 ' HA ' ' HG2' ' A' ' 208' ' ' LYS . 21.6 t -75.69 -25.78 17.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 120.867 0.365 . . . . 0.0 111.099 -176.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 205' ' ' ARG . 13.3 mtp180 -76.21 -10.43 59.4 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.128 0.489 . . . . 0.0 110.553 173.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -121.74 -146.95 0.38 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.466 176.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -67.01 114.33 5.71 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.789 0.804 . . . . 0.0 109.316 171.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.664 ' HG2' ' HA ' ' A' ' 204' ' ' VAL . 86.6 mttt -72.61 3.02 5.42 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 114.152 -1.385 . . . . 0.0 112.187 -172.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -168.25 -72.81 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.668 -0.242 . . . . 0.0 110.377 175.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 25.8 pttm 179.64 -19.81 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 C-N-CA 122.259 0.223 . . . . 0.0 110.827 176.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 57.0 m 68.49 104.06 0.05 Allowed 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 121.426 0.632 . . . . 0.0 110.878 -177.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -81.97 84.51 6.93 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.759 -0.655 . . . . 0.0 110.333 -178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 79.4 mt -109.92 -56.08 2.36 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.036 0.446 . . . . 0.0 110.107 -179.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 91.2 mttt -137.46 174.75 10.26 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.487 -0.779 . . . . 0.0 109.782 -178.021 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -100.38 -51.27 3.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.297 0.57 . . . . 0.0 109.825 176.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -87.61 88.72 7.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.495 177.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 9.1 p -92.47 -80.56 0.36 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.619 178.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -148.34 96.43 0.17 Allowed Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 111.683 -0.567 . . . . 0.0 111.683 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 34.4 m -98.55 158.71 3.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 N-CA-C 110.22 -0.289 . . . . 0.0 110.22 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 39.2 t-80 . . . . . 0 C--O 1.246 0.881 0 CA-C-O 118.535 -0.745 . . . . 0.0 109.904 -179.113 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 5.8 p . . . . . 0 N--CA 1.475 0.816 0 CA-C-O 121.296 0.569 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -89.59 130.35 35.91 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.01 0.433 . . . . 0.0 110.689 -176.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -132.44 96.32 3.82 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.277 175.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 25.5 p -133.8 130.75 38.41 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.779 -178.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -134.2 137.8 44.66 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.298 -0.631 . . . . 0.0 109.298 174.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 67.9 m-70 -81.15 155.1 26.38 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.579 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 120.46 172.21 14.66 Favored Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.307 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 34.0 m -84.37 -19.4 9.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.821 0.343 . . . . 0.0 110.71 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 141.55 -41.05 1.27 Allowed Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.644 -0.788 . . . . 0.0 112.855 175.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.1 t -69.89 -27.04 64.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.863 0.364 . . . . 0.0 111.016 -176.36 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.412 ' HA ' ' CZ2' ' B' ' 518' ' ' TRP . 7.2 mp0 -66.68 -52.66 42.21 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.521 -0.548 . . . . 0.0 109.521 178.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.0 t -63.01 -34.06 76.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.885 178.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.505 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 42.2 tp -59.24 -50.85 72.43 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.829 175.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.525 ' O ' HG23 ' B' ' 471' ' ' VAL . 68.5 t80 -52.91 -52.45 57.64 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.72 175.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.533 ' HE2' HD11 ' A' ' 201' ' ' ILE . 35.2 m-85 -62.87 -36.51 83.54 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 -176.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -67.27 -39.01 86.0 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 178.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . 0.505 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 64.0 mttm -59.85 -49.65 76.86 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.397 174.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.601 HG13 HD21 ' B' ' 509' ' ' LEU . 64.2 t -55.95 -48.0 79.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-O 121.334 0.587 . . . . 0.0 110.302 177.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -59.59 -33.67 71.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.05 -177.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -86.26 -50.18 7.14 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.415 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -67.76 -32.4 72.96 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.694 0.628 . . . . 0.0 112.694 -171.464 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 6.5 mp -66.86 -21.04 66.03 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -179.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 78.9 mtp180 64.93 0.43 1.2 Allowed 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 112.754 0.649 . . . . 0.0 112.754 176.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 40.4 t -134.82 129.98 35.35 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 120.915 0.388 . . . . 0.0 110.86 -177.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -66.03 -39.23 90.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.364 176.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -66.12 -31.51 72.41 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.96 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.609 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.78 -47.19 79.01 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.976 0.417 . . . . 0.0 110.283 176.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.439 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 75.8 t80 -65.75 -35.9 82.04 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.832 176.856 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -63.29 -38.03 89.55 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.442 176.343 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.458 ' HA ' ' HB2' ' B' ' 486' ' ' ARG . 7.1 t30 -72.78 -30.99 64.55 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.12 0.486 . . . . 0.0 110.323 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.45 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 68.4 t80 -60.48 -50.48 73.4 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.314 0.578 . . . . 0.0 109.471 171.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' B' ' 481' ' ' TYR . 75.5 mt -64.83 -29.1 70.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.518 -0.764 . . . . 0.0 110.457 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.717 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 2.4 tpp85 -60.19 -49.11 78.9 Favored 'General case' 0 C--O 1.238 0.486 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.861 176.113 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 37.9 m -63.04 -31.13 72.2 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.57 175.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.575 HD22 ' CD1' ' A' ' 200' ' ' PHE . 33.6 mt -68.88 -45.19 71.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.585 179.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.437 ' O ' ' HG3' ' B' ' 493' ' ' GLN . 16.2 m -65.83 -40.73 88.45 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.125 0 C-N-CA 120.635 -0.426 . . . . 0.0 111.264 -178.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.553 HD13 ' HE1' ' A' ' 186' ' ' PHE . 39.9 pt -67.84 -32.44 56.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 C-N-CA 119.689 -0.804 . . . . 0.0 110.487 177.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 93.9 t80 -63.93 -43.03 97.13 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.01 0.433 . . . . 0.0 110.251 175.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -63.5 -29.64 70.88 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.186 -178.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . 0.437 ' HG3' ' O ' ' B' ' 489' ' ' VAL . 79.3 mt-30 -95.17 17.84 13.42 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.799 -177.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 59.95 27.15 16.48 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.407 0.683 . . . . 0.0 112.056 177.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.522 ' O ' ' HD2' ' A' ' 160' ' ' ARG . 88.0 t -78.21 -41.56 26.6 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-O 121.303 0.573 . . . . 0.0 109.606 177.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' B' ' 500' ' ' GLU . 48.1 pt -124.68 154.17 32.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.819 177.001 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 15.3 t -102.94 -169.4 1.65 Allowed 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 178.421 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.515 ' O ' HG23 ' B' ' 502' ' ' VAL . 19.5 ttm180 -55.54 -55.48 31.47 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.442 -176.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -54.01 -50.45 66.6 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.486 -176.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.545 ' HB2' ' HB ' ' B' ' 496' ' ' ILE . 2.4 mp0 -59.91 -46.31 89.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.479 -0.328 . . . . 0.0 111.118 -179.895 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.422 HD23 HD21 ' B' ' 523' ' ' LEU . 65.2 tp -57.83 -44.7 86.62 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.918 0.39 . . . . 0.0 111.114 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.64 HG22 HD23 ' B' ' 523' ' ' LEU . 59.7 t -67.79 -36.39 75.71 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.818 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.443 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 26.5 mt-30 -77.27 -35.11 55.47 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.896 -0.593 . . . . 0.0 112.266 -177.048 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 91.1 mt -65.7 -37.71 87.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.054 0.454 . . . . 0.0 111.503 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 5.7 p -87.11 6.7 2.91 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-O 121.153 0.501 . . . . 0.0 110.967 -177.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.574 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 21.6 t -59.01 -49.2 94.62 Favored Pre-proline 0 CA--C 1.542 0.638 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.741 179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.574 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 36.8 Cg_exo -63.06 -6.38 9.51 Favored 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.228 1.952 . . . . 0.0 113.132 177.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.479 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 68.3 m-85 -108.4 -66.02 1.08 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.665 -178.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.601 HD21 HG13 ' B' ' 471' ' ' VAL . 82.4 mt -90.99 -13.15 33.89 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.533 -174.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -69.72 -12.06 66.81 Favored Glycine 0 C--O 1.23 -0.109 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.077 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.405 ' HE3' ' OE1' ' A' ' 141' ' ' GLN . 28.8 mtpp -80.15 -13.66 59.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.352 0.596 . . . . 0.0 109.8 176.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -121.76 89.47 47.84 Favored Pre-proline 0 N--CA 1.451 -0.416 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.809 -179.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . 0.407 ' O ' ' HB2' ' B' ' 517' ' ' ASN . 74.4 Cg_exo -51.88 -35.94 61.68 Favored 'Trans proline' 0 C--N 1.344 0.294 0 C-N-CA 123.319 2.679 . . . . 0.0 113.313 -177.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -71.18 -48.64 50.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.275 0.559 . . . . 0.0 110.408 -179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.524 HD23 HD22 ' B' ' 509' ' ' LEU . 18.0 tp -67.07 -38.8 86.42 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.475 0.655 . . . . 0.0 110.044 -178.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -67.29 -32.33 73.25 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.031 178.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . 0.407 ' HB2' ' O ' ' B' ' 513' ' ' PRO . 0.2 OUTLIER -64.75 -40.46 95.33 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.943 -0.571 . . . . 0.0 109.821 176.721 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.412 ' CZ2' ' HA ' ' B' ' 464' ' ' GLU . 9.7 t90 -58.65 -49.22 78.31 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.553 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 18.2 t80 -56.95 -46.08 82.37 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.909 -179.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -63.66 -37.05 85.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.172 178.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -65.34 -38.91 91.55 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.438 -177.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -82.42 -35.02 28.01 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.562 0.696 . . . . 0.0 109.745 -175.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.64 HD23 HG22 ' B' ' 502' ' ' VAL . 11.8 tp -85.31 -24.9 27.49 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 114.857 -1.065 . . . . 0.0 111.367 -173.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 88.87 26.99 25.22 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.638 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 53.8 t80 -86.92 124.22 32.89 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.844 0.354 . . . . 0.0 110.272 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 57.3 mttp -119.59 151.19 39.06 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.64 177.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -75.78 57.71 1.04 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.029 0.442 . . . . 0.0 110.792 177.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--O 1.25 1.123 0 CA-C-O 118.822 -0.609 . . . . 0.0 109.966 -179.748 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 27.6 t . . . . . 0 N--CA 1.48 1.07 0 CA-C-O 120.496 0.189 . . . . 0.0 111.18 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -66.72 -60.13 2.96 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.728 0.299 . . . . 0.0 110.303 -178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -134.91 149.65 50.3 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.275 176.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -136.91 84.25 0.25 Allowed Glycine 0 N--CA 1.448 -0.505 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.292 -179.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.5 p -129.23 14.52 6.17 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 121.064 0.459 . . . . 0.0 110.629 178.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -71.24 167.95 18.33 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.632 178.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 33.2 t70 73.78 -73.03 0.1 Allowed 'General case' 0 N--CA 1.471 0.614 0 O-C-N 123.979 0.799 . . . . 0.0 111.119 -178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -149.27 111.03 4.54 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.626 0.25 . . . . 0.0 110.895 178.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -75.37 -46.95 13.67 Favored Glycine 0 N--CA 1.446 -0.64 0 C-N-CA 120.578 -0.82 . . . . 0.0 111.293 175.095 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 100.3 48.68 1.53 Allowed Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 121.112 -0.566 . . . . 0.0 112.474 179.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -82.04 -54.14 5.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.714 0.292 . . . . 0.0 111.113 -178.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 19.0 m -76.88 119.13 76.19 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 116.499 -0.319 . . . . 0.0 111.177 -177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -80.95 161.02 21.04 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 122.769 2.313 . . . . 0.0 112.136 179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . 0.523 HG13 ' HB3' ' B' ' 511' ' ' LYS . 39.8 t -107.6 90.04 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.567 0 CA-C-O 120.833 0.349 . . . . 0.0 110.526 179.54 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -160.69 88.53 0.78 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.405 179.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 3.5 t70 63.59 114.57 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.523 0 O-C-N 124.117 0.886 . . . . 0.0 112.35 174.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.552 ' O ' ' HD2' ' B' ' 476' ' ' ARG . 1.1 pp -118.11 144.41 26.23 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.591 ' O ' ' HB2' ' B' ' 477' ' ' SER . 7.4 t70 -102.4 -46.25 4.84 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.481 -0.781 . . . . 0.0 109.31 173.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.2 m -154.32 95.35 2.74 Favored Pre-proline 0 C--O 1.234 0.278 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.576 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.531 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 7.4 Cg_exo -70.81 147.23 55.65 Favored 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.305 2.003 . . . . 0.0 111.064 174.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -107.92 152.44 24.43 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.892 -176.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 5.5 p -99.6 121.27 50.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 CA-C-O 121.148 0.499 . . . . 0.0 110.348 177.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -77.57 121.09 23.43 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 109.338 -0.616 . . . . 0.0 109.338 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.422 HD23 HD22 ' B' ' 504' ' ' LEU . 85.3 mt -109.38 8.27 25.38 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.153 0.501 . . . . 0.0 110.616 -179.568 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -90.8 -25.94 19.68 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.446 179.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.472 ' OE1' ' HB3' ' B' ' 503' ' ' GLN . 25.6 pt20 -63.71 -26.42 68.65 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.339 -0.846 . . . . 0.0 111.458 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.717 HD22 ' HB3' ' B' ' 500' ' ' GLU . 63.7 mt -66.31 161.8 21.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.404 -177.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 48.7 mm-40 -79.15 154.63 29.16 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.606 175.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.566 HG13 ' CD1' ' A' ' 178' ' ' LEU . 37.0 t -61.31 -39.25 82.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 121.105 -0.238 . . . . 0.0 110.808 179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . 0.403 ' O ' ' HB2' ' A' ' 160' ' ' ARG . 5.6 p30 -64.66 -30.01 71.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.541 0.21 . . . . 0.0 110.479 179.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . . . . . . . . . 17.2 m -68.9 -45.96 69.56 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.127 0.489 . . . . 0.0 110.395 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 93.4 mt -65.28 -41.3 94.29 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.713 179.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . 0.408 ' O ' ' HG3' ' A' ' 163' ' ' ARG . 82.8 mtp180 -66.35 -33.36 75.55 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.455 177.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.473 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 18.3 ttm180 -65.41 -44.71 86.57 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 -179.209 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.548 ' HA ' HG13 ' B' ' 495' ' ' VAL . 68.0 t80 -55.74 -50.16 71.13 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.552 174.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.457 ' NZ ' HG21 ' A' ' 181' ' ' ILE . 21.3 mtpp -64.66 -38.71 91.93 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.442 -176.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.408 ' HG3' ' O ' ' A' ' 159' ' ' ARG . 81.8 mtp180 -76.9 -34.77 57.71 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.764 0.316 . . . . 0.0 110.738 -178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 10.4 t60 -69.85 -47.68 61.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.798 0.332 . . . . 0.0 110.522 -179.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -85.06 -1.89 57.36 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.443 -178.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm 58.49 81.36 0.16 Allowed 'General case' 0 N--CA 1.464 0.23 0 O-C-N 123.722 0.639 . . . . 0.0 111.129 -179.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.43 HD12 ' HG2' ' A' ' 162' ' ' LYS . 82.4 mt -116.19 100.53 53.56 Favored Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.626 -178.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -56.47 141.72 89.86 Favored 'Trans proline' 0 C--O 1.234 0.322 0 C-N-CA 123.263 2.642 . . . . 0.0 111.978 -177.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.417 ' CG2' HD11 ' A' ' 173' ' ' LEU . 4.1 t -167.98 146.42 4.53 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.892 -0.594 . . . . 0.0 110.712 -178.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -74.59 157.81 85.69 Favored Pre-proline 0 C--N 1.323 -0.56 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.13 179.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -68.34 171.43 12.85 Favored 'Trans proline' 0 C--O 1.234 0.307 0 C-N-CA 122.602 2.201 . . . . 0.0 112.08 177.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 81.69 33.58 27.21 Favored Glycine 0 N--CA 1.448 -0.504 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.793 -178.037 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.417 HD11 ' CG2' ' A' ' 169' ' ' THR . 83.5 mt -82.85 147.03 28.57 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.233 0.54 . . . . 0.0 111.29 -178.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -120.09 -175.56 3.01 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.726 176.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.669 ' O ' HG23 ' A' ' 179' ' ' VAL . 19.6 tptm -58.87 -58.37 8.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.53 -0.305 . . . . 0.0 111.233 -178.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -58.62 -33.28 69.85 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 0.0 111.359 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -59.96 -50.45 73.69 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.306 0.574 . . . . 0.0 110.739 178.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.566 ' CD1' HG13 ' A' ' 155' ' ' VAL . 68.1 mt -60.51 -43.65 96.85 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.174 178.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.669 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.9 t -57.85 -45.76 87.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.972 -178.471 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -60.62 -46.6 89.65 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.08 179.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.457 HG21 ' NZ ' ' A' ' 162' ' ' LYS . 63.1 mt -65.4 -45.72 92.3 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-O 120.849 0.357 . . . . 0.0 110.854 -179.218 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.436 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 66.3 t -60.74 -49.54 84.13 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.539 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.787 -179.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.13 -38.56 95.8 Favored Glycine 0 N--CA 1.449 -0.444 0 C-N-CA 121.169 -0.538 . . . . 0.0 112.235 -179.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 50.3 t -58.21 -51.55 69.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.575 0.226 . . . . 0.0 110.772 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 57.9 t-80 -80.83 -24.5 38.4 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.744 0.307 . . . . 0.0 111.183 -177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.444 ' CE1' HD13 ' B' ' 490' ' ' ILE . 15.5 t80 -61.48 -44.64 96.74 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.452 -178.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -82.37 22.6 0.83 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.952 0.406 . . . . 0.0 111.416 178.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 24.2 m -126.99 22.58 6.68 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.169 0.509 . . . . 0.0 110.143 177.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.714 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 71.9 mt -97.72 118.83 63.63 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.183 -179.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 7.1 Cg_exo -72.93 113.48 3.78 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 122.969 2.446 . . . . 0.0 110.807 174.305 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.411 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.7 p -119.49 156.43 21.87 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 CA-C-O 120.877 0.37 . . . . 0.0 111.18 -172.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . 0.501 ' O ' ' HB ' ' A' ' 196' ' ' THR . 92.3 m-20 -107.71 147.84 30.22 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.093 179.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.643 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 37.7 tt0 -72.28 -66.4 0.65 Allowed 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.549 -0.46 . . . . 0.0 110.597 177.229 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 39.2 ttpt -73.43 -45.25 55.59 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.495 -172.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -62.76 -42.74 99.82 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.158 -176.192 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' A' ' 192' ' ' ASN . 99.4 m -72.68 -38.03 67.71 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.359 -178.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.643 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 37.6 mt -57.69 -51.01 71.28 Favored 'General case' 0 CA--C 1.521 -0.142 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 174.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 19.5 m -58.49 -44.73 89.5 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.623 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 1.2 t -55.06 -54.72 39.52 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.361 178.403 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.593 ' CD1' HD22 ' B' ' 488' ' ' LEU . 70.0 t80 -57.79 -48.65 79.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.616 -177.569 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.478 HG13 ' O ' ' A' ' 197' ' ' LEU . 91.7 mt -54.89 -51.7 50.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.333 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.944 -178.025 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -67.42 -30.73 70.56 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.741 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.8 m -63.64 -52.03 62.6 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.401 . . . . 0.0 110.931 178.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 200' ' ' PHE . 13.7 t -68.63 -27.67 37.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.166 0.508 . . . . 0.0 110.264 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.4 ' HD3' HG22 ' A' ' 201' ' ' ILE . 68.8 mtp180 -87.5 16.1 5.88 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.362 176.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . 0.428 HD22 ' HA ' ' A' ' 206' ' ' ASN . 0.5 OUTLIER -120.64 -82.69 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.582 175.529 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.532 ' CG ' ' H ' ' A' ' 208' ' ' LYS . 5.2 p-10 -142.45 -94.88 0.12 Allowed 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.763 -179.026 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.532 ' H ' ' CG ' ' A' ' 207' ' ' ASP . 70.9 mmtt 59.92 80.06 0.21 Allowed 'General case' 0 C--N 1.328 -0.332 0 O-C-N 123.57 0.544 . . . . 0.0 110.859 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 63.7 t30 75.35 168.94 0.28 Allowed 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.093 -0.958 . . . . 0.0 110.399 -178.471 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 59.6 tttp 72.92 116.4 0.05 Allowed 'General case' 0 N--CA 1.465 0.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.295 -178.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 29.8 m -69.73 -30.51 68.14 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.568 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . 0.416 ' O ' ' HB2' ' A' ' 213' ' ' LEU . 37.9 t70 61.56 87.35 0.1 Allowed 'General case' 0 C--O 1.233 0.185 0 O-C-N 123.849 0.718 . . . . 0.0 110.083 -179.007 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . 0.416 ' HB2' ' O ' ' A' ' 212' ' ' ASP . 10.6 mp 69.36 106.16 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 114.834 -1.076 . . . . 0.0 111.117 -175.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 25.4 ttmm -83.41 -29.2 28.32 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.907 179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -147.3 144.41 28.78 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.853 178.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -68.06 -39.4 82.98 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.804 -178.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 6.6 t -159.31 149.63 19.22 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -166.25 59.08 0.24 Allowed Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.084 178.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 7.8 p -65.48 126.46 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.135 0.493 . . . . 0.0 110.812 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 29.2 m80 . . . . . 0 C--O 1.247 0.968 0 CA-C-O 118.602 -0.713 . . . . 0.0 110.353 178.528 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . 0.431 ' C ' HD22 ' B' ' 455' ' ' ASN . 35.7 m . . . . . 0 N--CA 1.477 0.893 0 CA-C-O 120.641 0.258 . . . . 0.0 110.722 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . 0.431 HD22 ' C ' ' B' ' 454' ' ' SER . 0.8 OUTLIER -130.19 129.0 42.84 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.711 0.291 . . . . 0.0 110.798 -178.826 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -154.42 141.52 19.38 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.877 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 8.1 t -95.95 85.29 4.02 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 120.969 0.414 . . . . 0.0 110.711 -178.743 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt 56.52 -85.47 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 124.212 1.005 . . . . 0.0 112.763 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 32.4 m170 65.59 88.76 0.1 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.073 0.549 . . . . 0.0 111.043 -173.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . -107.38 -111.45 3.55 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.28 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 5.4 p -100.41 160.27 3.63 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 133.12 -6.4 5.06 Favored Glycine 0 C--N 1.331 0.273 0 C-N-CA 120.463 -0.875 . . . . 0.0 112.738 -179.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 7.5 t -82.97 -1.63 52.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.193 0.52 . . . . 0.0 110.825 -178.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.451 ' CD ' ' H ' ' B' ' 464' ' ' GLU . 1.9 mp0 -58.81 -36.83 75.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.883 -0.598 . . . . 0.0 109.906 174.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.3 t -60.01 -39.49 85.99 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.839 178.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.415 ' HG ' ' HE2' ' B' ' 470' ' ' LYS . 59.9 tp -60.56 -49.07 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.065 177.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -53.73 -54.92 31.32 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.877 -0.601 . . . . 0.0 111.777 175.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.478 ' HE2' HD11 ' A' ' 201' ' ' ILE . 38.6 m-85 -65.32 -33.56 76.27 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.602 -0.272 . . . . 0.0 111.73 -175.334 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.53 -42.76 98.41 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.982 0.42 . . . . 0.0 110.133 176.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . 0.415 ' HE2' ' HG ' ' B' ' 466' ' ' LEU . 65.8 mttm -58.42 -51.29 70.47 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.27 174.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . . . . . . . . . 93.8 t -57.07 -44.35 82.87 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.233 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.95 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 27.4 ttp180 -58.03 -37.44 74.36 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.481 -0.781 . . . . 0.0 111.382 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 52.3 tttp -86.86 -38.42 16.79 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.979 0.419 . . . . 0.0 111.351 -179.392 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.643 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -65.88 -49.19 68.98 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 -174.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 9.9 mp -63.75 -31.14 72.22 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.216 -177.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.552 ' HD2' ' O ' ' A' ' 143' ' ' ILE . 34.9 ttm180 69.32 -59.47 0.48 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.951 0.782 . . . . 0.0 111.986 177.071 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.591 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 14.1 t -64.42 130.8 45.15 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.92 -178.04 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.92 -34.43 78.11 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.326 176.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -69.63 -39.27 77.24 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.531 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -66.62 -44.39 82.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.156 177.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.422 ' CE2' HD11 ' B' ' 485' ' ' LEU . 84.5 t80 -64.91 -41.14 95.83 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.931 0.396 . . . . 0.0 110.045 177.506 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.598 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 32.2 tt0 -60.07 -43.42 95.49 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.822 -0.627 . . . . 0.0 109.547 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.6 -45.26 89.5 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.811 178.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.491 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 63.3 t80 -54.33 -48.78 70.99 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.359 174.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.422 HD11 ' CE2' ' B' ' 481' ' ' TYR . 82.9 mt -63.88 -34.7 78.55 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.769 -0.65 . . . . 0.0 110.943 179.791 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.714 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 18.9 mtt85 -66.23 -36.98 84.43 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.744 0.307 . . . . 0.0 110.339 176.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.8 m -61.37 -34.27 75.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.126 0.488 . . . . 0.0 109.752 174.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.593 HD22 ' CD1' ' A' ' 200' ' ' PHE . 39.7 mt -68.23 -45.14 74.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.453 -179.425 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.484 HG22 ' HA ' ' B' ' 486' ' ' ARG . 14.9 m -67.14 -42.5 88.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 C-N-CA 120.811 -0.356 . . . . 0.0 111.694 -178.125 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.444 HD13 ' CE1' ' A' ' 186' ' ' PHE . 28.0 pt -68.54 -31.18 50.05 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.515 179.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -64.2 -43.91 93.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 110.146 173.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -62.3 -37.33 85.11 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.199 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -83.8 16.0 2.99 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.772 -176.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 69.4 mm-40 67.35 10.95 8.11 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 122.608 0.363 . . . . 0.0 111.665 177.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 161' ' ' TYR . 77.2 t -70.91 -42.46 77.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.741 0.305 . . . . 0.0 111.61 -174.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 45.3 pt -117.56 151.25 19.52 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 C-N-CA 120.714 -0.395 . . . . 0.0 110.732 179.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.709 ' HB2' ' HG2' ' B' ' 500' ' ' GLU . 13.5 m -75.49 160.03 30.65 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 175.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' B' ' 501' ' ' LEU . 16.5 ttp180 -67.48 -36.54 81.32 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.066 -0.254 . . . . 0.0 110.802 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -64.54 -43.95 92.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.832 0.349 . . . . 0.0 110.333 176.406 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.717 ' HB3' HD22 ' A' ' 153' ' ' LEU . 9.3 mm-40 -55.86 -38.8 70.6 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.656 176.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.433 ' HB3' ' O ' ' B' ' 498' ' ' ARG . 60.2 tp -61.58 -49.78 75.27 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.273 -0.876 . . . . 0.0 111.471 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.604 HG12 ' CZ ' ' B' ' 516' ' ' PHE . 0.4 OUTLIER -59.21 -39.88 79.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.243 0 CA-C-O 121.176 0.512 . . . . 0.0 109.791 179.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . 0.472 ' HB3' ' OE1' ' A' ' 152' ' ' GLN . 44.9 mt-30 -66.51 -42.0 87.99 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.806 179.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.551 HD21 HD11 ' A' ' 153' ' ' LEU . 50.2 mt -61.02 -41.97 97.57 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.878 0.37 . . . . 0.0 111.544 -178.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.711 HG22 ' HG ' ' B' ' 509' ' ' LEU . 5.0 p -87.09 4.06 4.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.016 -178.324 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.513 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 33.7 t -58.83 -48.39 96.91 Favored Pre-proline 0 CA--C 1.539 0.545 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.944 179.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.513 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 52.7 Cg_exo -56.73 -20.66 36.04 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 121.808 1.672 . . . . 0.0 112.734 176.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.434 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 72.8 m-85 -96.66 -60.59 1.57 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.182 -175.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.711 ' HG ' HG22 ' B' ' 505' ' ' VAL . 55.6 mt -84.61 -19.84 32.35 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.077 -175.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.16 -8.92 52.66 Favored Glycine 0 N--CA 1.453 -0.233 0 C-N-CA 121.316 -0.468 . . . . 0.0 112.344 -179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.523 ' HB3' HG13 ' A' ' 140' ' ' VAL . 55.6 mttm -73.31 -21.58 60.53 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 174.264 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.643 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 31.8 m-85 -128.0 101.96 22.31 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.222 -175.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -50.86 -49.55 16.57 Favored 'Trans proline' 0 C--N 1.343 0.276 0 C-N-CA 123.124 2.549 . . . . 0.0 112.704 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -56.9 -43.9 81.82 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 0.0 111.336 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 28.2 tp -71.58 -44.58 64.24 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.998 -174.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.604 ' CZ ' HG12 ' B' ' 502' ' ' VAL . 7.9 t80 -70.34 -29.94 66.76 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.429 -178.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -67.27 -42.26 84.13 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.075 -0.511 . . . . 0.0 109.842 176.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 4.7 t90 -54.96 -48.52 73.1 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.484 175.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.529 ' HE2' ' HA ' ' B' ' 502' ' ' VAL . 29.5 t80 -56.45 -51.38 68.65 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.967 179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.457 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 99.2 mttt -59.53 -34.98 73.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.855 0.359 . . . . 0.0 110.917 178.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -66.69 -35.33 79.88 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.013 -178.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -78.91 -34.09 44.96 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.22 0.533 . . . . 0.0 110.367 -178.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.451 ' CD2' HG22 ' B' ' 502' ' ' VAL . 11.0 mp -80.7 -16.26 54.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.401 179.682 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 69.85 37.11 75.0 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.601 -0.809 . . . . 0.0 111.287 -175.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 14.1 t80 -86.41 86.7 7.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.111 0.481 . . . . 0.0 110.446 -176.361 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -84.32 114.69 22.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.258 178.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -90.59 5.52 47.52 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.452 0.644 . . . . 0.0 110.406 178.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 C--O 1.251 1.169 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.516 179.849 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 16.9 m . . . . . 0 N--CA 1.475 0.791 0 CA-C-O 120.556 0.217 . . . . 0.0 110.555 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 49.7 t30 74.48 -65.11 0.36 Allowed 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 123.613 0.765 . . . . 0.0 111.275 178.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -92.07 111.05 22.44 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.632 -179.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -114.2 -176.2 19.0 Favored Glycine 0 N--CA 1.445 -0.719 0 C-N-CA 120.978 -0.63 . . . . 0.0 111.914 178.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 49.2 m -89.82 127.32 35.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.945 0.402 . . . . 0.0 111.175 -177.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -87.09 -56.79 3.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.273 0.558 . . . . 0.0 109.558 176.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -76.77 -43.88 35.19 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.25 -0.886 . . . . 0.0 109.874 178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 25.0 t70 57.96 67.88 0.9 Allowed 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.459 -0.792 . . . . 0.0 110.396 177.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . -104.3 48.91 0.96 Allowed Glycine 0 N--CA 1.446 -0.666 0 CA-C-N 115.505 -0.771 . . . . 0.0 113.312 -174.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -103.47 -37.07 3.13 Favored Glycine 0 N--CA 1.446 -0.655 0 C-N-CA 120.5 -0.857 . . . . 0.0 110.96 174.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -85.7 -31.59 22.39 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.06 -0.57 . . . . 0.0 110.509 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 24.0 t -134.72 127.36 18.45 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-N 115.866 -0.606 . . . . 0.0 109.694 178.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -76.86 174.17 13.29 Favored 'Trans proline' 0 C--O 1.236 0.409 0 C-N-CA 122.551 2.168 . . . . 0.0 112.527 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 5.4 p -62.89 121.26 11.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.767 177.64 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -138.03 110.65 7.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.231 179.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' B' ' 477' ' ' SER . 18.4 t70 -91.52 -3.25 56.72 Favored 'General case' 0 C--N 1.318 -0.786 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 173.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . 0.44 ' HB ' ' HD3' ' A' ' 146' ' ' PRO . 10.5 mm 66.8 17.27 0.06 OUTLIER 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.488 179.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 37.7 t70 61.32 13.4 4.9 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 113.879 -1.509 . . . . 0.0 110.632 -176.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 89.0 m 65.39 94.29 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.586 -176.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.639 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 31.6 Cg_exo -58.86 152.63 56.19 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.707 2.271 . . . . 0.0 111.756 177.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 4.7 pt-20 -123.53 135.65 54.13 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.104 -174.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . 0.524 HG11 HD21 ' B' ' 483' ' ' ASN . 4.1 p -96.23 124.77 49.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.53 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.315 -177.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.533 ' O ' ' HG2' ' A' ' 152' ' ' GLN . 50.9 m-20 -86.39 110.82 19.96 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.25 176.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . 0.436 HD13 HG12 ' A' ' 182' ' ' VAL . 65.8 mt -90.68 -3.84 57.2 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.423 0.63 . . . . 0.0 109.885 177.109 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -77.1 -11.16 59.77 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.36 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 149' ' ' ASP . 29.7 pt20 -90.63 -9.38 47.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.291 -177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.419 HD22 ' HB3' ' B' ' 500' ' ' GLU . 82.8 mt -77.08 166.06 23.78 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.2 0.524 . . . . 0.0 111.649 -175.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . 0.437 ' HB2' ' OG1' ' A' ' 157' ' ' THR . 17.2 mt-30 -71.97 154.84 40.93 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.343 176.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 59.2 t -60.94 -42.56 93.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 110.615 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.34 -31.55 71.03 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.364 -179.044 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.437 ' OG1' ' HB2' ' A' ' 154' ' ' GLN . 10.0 m -66.12 -42.39 89.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.264 0.554 . . . . 0.0 110.469 179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 178' ' ' LEU . 75.7 mt -65.49 -41.62 93.04 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.249 177.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -63.66 -39.21 93.76 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.248 175.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.425 ' HG3' ' HA ' ' B' ' 495' ' ' VAL . 27.2 tpt180 -56.88 -52.89 63.35 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.477 177.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 58.1 t80 -52.34 -52.28 54.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.06 176.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.58 ' NZ ' HD12 ' A' ' 181' ' ' ILE . 58.6 mtpt -65.37 -31.5 72.64 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.598 -176.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -76.71 -47.85 20.63 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.605 0.24 . . . . 0.0 111.323 -179.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . 0.431 ' CE1' ' HB3' ' B' ' 493' ' ' GLN . 16.0 t-80 -70.09 -35.98 74.56 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.791 -175.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.452 ' CE1' HG22 ' B' ' 490' ' ' ILE . 59.0 m-85 -88.86 6.38 39.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.599 -0.273 . . . . 0.0 111.626 178.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt 56.76 51.42 10.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.73 175.289 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.425 ' HA ' ' HD3' ' A' ' 168' ' ' PRO . 90.7 mt -91.76 131.49 35.56 Favored Pre-proline 0 C--N 1.324 -0.503 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.575 -178.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 167' ' ' LEU . 36.0 Cg_exo -59.84 150.16 79.25 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.936 2.424 . . . . 0.0 111.855 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . . . . . . . . . 22.4 p -132.56 162.64 30.75 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.644 -177.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -119.83 151.76 52.81 Favored Pre-proline 0 C--N 1.322 -0.612 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.921 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -59.22 137.57 79.71 Favored 'Trans proline' 0 C--O 1.234 0.294 0 C-N-CA 122.428 2.086 . . . . 0.0 112.007 178.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 83.16 65.27 1.6 Allowed Glycine 0 N--CA 1.445 -0.718 0 C-N-CA 120.744 -0.741 . . . . 0.0 111.829 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 61.9 mt -82.81 141.32 32.39 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.409 0.623 . . . . 0.0 111.306 178.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.528 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 17.1 t-20 -137.48 166.6 23.47 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.076 -0.965 . . . . 0.0 108.671 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.612 ' O ' HG23 ' A' ' 179' ' ' VAL . 22.8 tptm -50.3 -53.12 30.93 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.358 0.411 . . . . 0.0 110.699 178.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . 0.425 ' O ' ' HG3' ' A' ' 180' ' ' GLU . . . -59.79 -40.61 88.91 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.445 -178.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.47 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 24.6 mm-40 -60.05 -46.2 90.31 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.487 0.66 . . . . 0.0 110.257 179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.549 ' HB3' ' HB3' ' A' ' 158' ' ' LEU . 77.2 mt -60.73 -51.13 70.67 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.171 179.627 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.612 HG23 ' O ' ' A' ' 175' ' ' LYS . 46.3 t -57.28 -43.58 82.34 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.275 -177.629 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . 0.425 ' HG3' ' O ' ' A' ' 176' ' ' ALA . 47.6 mt-10 -58.74 -55.57 33.4 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.283 179.541 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . 0.58 HD12 ' NZ ' ' A' ' 162' ' ' LYS . 63.8 mt -63.22 -42.24 95.72 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.607 -178.152 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 47.2 t -58.66 -49.73 81.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.28 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.231 177.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' A' ' 187' ' ' LYS . . . -64.57 -37.24 94.15 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.131 -0.556 . . . . 0.0 112.247 -179.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 49.1 t -56.67 -48.1 78.35 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.741 0.305 . . . . 0.0 110.651 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 58.2 t-80 -83.58 -24.73 31.4 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.219 -0.592 . . . . 0.0 110.752 178.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.462 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 54.4 t80 -60.9 -34.28 74.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 183' ' ' GLY . 64.4 mttm -81.69 -1.03 45.39 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.896 178.193 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 10.4 t -130.96 45.63 2.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.085 0.469 . . . . 0.0 110.285 -175.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.716 ' HB ' ' HD2' ' B' ' 486' ' ' ARG . 64.2 mt -103.16 115.1 64.54 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.677 178.055 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -65.36 110.1 1.51 Allowed 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.349 2.033 . . . . 0.0 111.131 174.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.449 HG21 ' HB3' ' B' ' 485' ' ' LEU . 7.6 p -134.18 128.66 52.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 CA-C-O 121.067 0.461 . . . . 0.0 111.165 -174.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 58.0 t30 -104.42 126.45 51.52 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.097 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.661 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 38.5 tt0 -49.69 -65.21 0.6 Allowed 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -172.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 53.8 tptt -58.44 -50.04 75.14 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -170.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -60.45 -41.6 94.42 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 120.662 0.267 . . . . 0.0 110.934 -179.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 66.8 m -66.78 -41.6 87.4 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.966 -178.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.661 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 27.5 mt -58.31 -49.22 77.96 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 175.559 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 27.1 m -57.2 -47.24 81.79 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.04 -178.8 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 78.2 m -58.46 -54.85 42.33 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.074 -179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.495 ' CG ' HD22 ' B' ' 488' ' ' LEU . 92.6 t80 -60.94 -47.09 88.05 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.225 -176.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.439 ' O ' ' HG2' ' A' ' 205' ' ' ARG . 73.0 mt -57.58 -53.49 43.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.185 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -70.82 -22.66 62.31 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 121.133 -0.227 . . . . 0.0 111.287 -175.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 72.3 m -67.57 -50.81 56.68 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.611 -0.268 . . . . 0.0 110.652 175.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.605 ' HA ' ' O ' ' A' ' 207' ' ' ASP . 37.4 t -73.73 -25.06 20.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.258 0 CA-C-O 120.997 0.427 . . . . 0.0 111.068 -177.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 201' ' ' ILE . 12.2 mmm180 -61.96 -25.72 67.78 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.138 177.13 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -95.02 -56.69 2.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.738 0.304 . . . . 0.0 110.452 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . 0.605 ' O ' ' HA ' ' A' ' 204' ' ' VAL . 8.8 t70 -153.22 -161.57 1.3 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.434 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 10.1 mptt -113.65 15.4 18.86 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 110.209 -0.293 . . . . 0.0 110.209 -179.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . 0.831 HD21 ' HG2' ' B' ' 494' ' ' GLU . 6.1 t30 63.73 50.1 2.77 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.762 0.791 . . . . 0.0 109.755 179.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -113.89 134.25 54.93 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.901 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 1.3 m -90.88 91.56 8.4 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.634 -177.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -101.35 -49.04 4.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.978 0.418 . . . . 0.0 110.264 177.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 83.9 mt -78.45 112.15 15.21 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.471 178.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 47.4 pttt -145.19 114.25 6.97 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.712 -178.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . 56.32 83.6 0.09 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.62 -0.718 . . . . 0.0 112.129 179.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -105.86 -53.42 2.64 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.601 176.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 19.0 m -80.43 95.22 6.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.916 0.389 . . . . 0.0 110.193 178.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . -123.6 32.21 4.35 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 121.077 -0.582 . . . . 0.0 111.897 -177.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 31.9 m -69.51 -23.64 26.5 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.841 0.353 . . . . 0.0 110.877 -179.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 80.9 t60 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.472 -0.775 . . . . 0.0 109.745 177.472 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 69.4 m . . . . . 0 N--CA 1.474 0.773 0 CA-C-O 120.791 0.329 . . . . 0.0 110.522 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -85.08 -42.5 14.76 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.499 -179.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . 64.08 101.06 0.03 OUTLIER 'General case' 0 C--O 1.235 0.302 0 O-C-N 123.931 0.769 . . . . 0.0 111.348 -177.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 2.5 p -69.36 138.66 53.88 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.9 -179.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -132.59 105.14 7.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.487 -178.12 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 31.1 t-80 59.13 49.48 9.24 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.416 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 154.23 177.29 27.48 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.435 -0.888 . . . . 0.0 112.493 -179.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 56.9 t -109.3 -49.06 7.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.854 0.359 . . . . 0.0 110.761 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 162.92 -173.62 39.15 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.098 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 12.3 p -73.86 -12.69 60.75 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 111.858 0.318 . . . . 0.0 111.858 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -58.12 -52.01 67.31 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.963 0.411 . . . . 0.0 109.958 175.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 18.1 m -62.26 -34.54 76.74 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.444 178.477 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 56.5 tp -62.01 -48.81 78.65 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.349 177.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.554 ' O ' HG23 ' B' ' 471' ' ' VAL . 61.3 t80 -52.5 -55.72 20.08 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.834 176.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.534 ' CD1' HD22 ' A' ' 197' ' ' LEU . 79.2 m-85 -65.04 -32.78 74.67 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -174.396 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -63.19 -41.81 99.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.127 0.489 . . . . 0.0 109.897 174.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -68.36 -33.66 74.67 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.85 176.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.554 HG23 ' O ' ' B' ' 467' ' ' PHE . 97.2 t -61.47 -49.22 85.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.76 0.314 . . . . 0.0 110.511 177.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 11.4 ttm180 -62.77 -35.15 78.88 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.151 0.5 . . . . 0.0 109.869 178.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 6.1 ttmm -76.27 -23.85 54.46 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.467 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -88.42 -54.98 3.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.355 -177.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.9 mp -62.61 -44.35 96.53 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.146 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 88.6 mtt180 68.46 -56.95 0.5 Allowed 'General case' 0 N--CA 1.469 0.522 0 O-C-N 124.011 0.819 . . . . 0.0 112.588 173.964 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.489 ' HB2' ' O ' ' A' ' 142' ' ' ASP . 21.8 t -59.11 137.96 57.75 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 122.798 0.439 . . . . 0.0 110.802 -177.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -60.32 -55.92 27.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.309 -176.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -60.93 -32.82 72.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.895 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.639 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -68.77 -50.97 46.04 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.473 -178.179 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -66.27 -37.43 85.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.992 0.425 . . . . 0.0 110.328 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.711 ' O ' ' HG2' ' B' ' 486' ' ' ARG . 26.4 tt0 -67.21 -34.54 77.71 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.98 -0.555 . . . . 0.0 109.77 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . 0.524 HD21 HG11 ' A' ' 148' ' ' VAL . 20.7 t-20 -59.94 -43.4 94.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.129 0.49 . . . . 0.0 110.434 175.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . . . . . . . . . 78.0 t80 -56.1 -45.33 79.47 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.08 173.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.449 ' HB3' HG21 ' A' ' 191' ' ' VAL . 90.3 mt -66.51 -29.52 69.64 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.573 -0.739 . . . . 0.0 111.116 178.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.716 ' HD2' ' HB ' ' A' ' 189' ' ' ILE . 17.6 mmt85 -60.46 -46.25 90.75 Favored 'General case' 0 CA--C 1.517 -0.3 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 174.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 59.7 m -61.97 -34.94 77.06 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.667 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.495 HD22 ' CG ' ' A' ' 200' ' ' PHE . 38.8 mt -66.61 -49.37 66.54 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.525 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 9.7 m -64.71 -42.01 93.81 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.197 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.672 -177.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.452 HG22 ' CE1' ' A' ' 165' ' ' PHE . 12.1 pt -69.91 -31.11 46.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 C-N-CA 120.428 -0.509 . . . . 0.0 111.128 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . 0.499 ' HB2' HD12 ' B' ' 501' ' ' LEU . 91.2 t80 -65.44 -44.0 88.64 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.167 0.508 . . . . 0.0 109.817 173.244 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.19 -35.52 79.11 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.653 179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . 0.431 ' HB3' ' CE1' ' A' ' 164' ' ' HIS . 77.7 mt-30 -83.62 14.6 3.7 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.644 -179.567 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . 0.831 ' HG2' HD21 ' A' ' 209' ' ' ASN . 34.7 mt-10 62.22 28.91 17.3 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-O 120.643 0.259 . . . . 0.0 111.149 176.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.425 ' HA ' ' HG3' ' A' ' 160' ' ' ARG . 69.1 t -87.46 -50.58 13.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.067 -178.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . . . . . . . . . 46.4 pt -111.26 148.08 14.8 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 178.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 54.3 p -91.7 -178.66 5.12 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.612 -0.267 . . . . 0.0 110.446 179.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.711 ' HD3' ' HB2' ' B' ' 525' ' ' TYR . 26.6 ttm180 -55.99 -52.3 64.69 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.893 -179.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.55 -48.35 81.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.352 -177.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.487 ' O ' ' HG ' ' B' ' 504' ' ' LEU . 7.7 mm-40 -57.21 -46.77 82.61 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.605 -179.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.499 HD12 ' HB2' ' B' ' 491' ' ' PHE . 9.6 tt -61.76 -49.29 76.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.051 -178.784 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.424 HG23 ' O ' ' B' ' 498' ' ' ARG . 94.7 t -63.15 -30.68 50.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 120.878 0.371 . . . . 0.0 111.008 -176.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 52.2 mt-30 -77.11 -36.65 55.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.557 -0.292 . . . . 0.0 111.696 178.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 500' ' ' GLU . 67.4 mt -65.63 -41.19 92.94 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-O 120.876 0.37 . . . . 0.0 111.506 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 7.3 p -84.25 8.84 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.17 0.51 . . . . 0.0 111.206 -176.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.651 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 35.6 t -57.46 -53.05 69.6 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-N 116.156 -0.475 . . . . 0.0 112.054 -179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.651 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 17.1 Cg_exo -69.09 0.2 5.48 Favored 'Trans proline' 0 C--N 1.356 0.972 0 C-N-CA 122.409 2.073 . . . . 0.0 112.93 -179.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.459 ' CE2' ' HB2' ' A' ' 146' ' ' PRO . 81.6 m-85 -109.56 -69.35 0.87 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.822 0.344 . . . . 0.0 110.565 -179.438 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' B' ' 516' ' ' PHE . 70.0 mt -86.75 -16.85 35.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.626 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.22 -15.29 65.26 Favored Glycine 0 N--CA 1.453 -0.204 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.277 -179.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -84.18 -11.91 55.76 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.182 0.515 . . . . 0.0 110.2 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -123.03 93.71 48.0 Favored Pre-proline 0 C--N 1.327 -0.388 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.692 -178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -50.51 -54.14 5.95 Favored 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 123.641 2.894 . . . . 0.0 113.555 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.74 -34.91 70.02 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -177.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.497 HD12 ' HA ' ' B' ' 515' ' ' LEU . 4.4 tp -80.56 -39.95 26.78 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.001 0.429 . . . . 0.0 110.257 -176.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.478 ' HB2' ' O ' ' B' ' 509' ' ' LEU . 2.9 t80 -67.61 -38.65 84.24 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.852 178.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 79.1 m-20 -65.69 -42.66 90.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.68 176.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 15.5 t90 -57.5 -48.05 80.27 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 177.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.45 ' CE2' HD21 ' B' ' 501' ' ' LEU . 0.2 OUTLIER -58.91 -46.58 87.57 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.348 -178.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -61.96 -44.74 96.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.393 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 62.7 t30 -64.31 -40.53 96.1 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.712 -177.077 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 12.4 t80 -69.9 -41.97 73.99 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.507 179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.467 HD21 ' CZ ' ' A' ' 200' ' ' PHE . 78.2 mt -77.93 -6.89 55.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.297 -0.41 . . . . 0.0 112.104 -177.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 72.27 32.17 62.92 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.043 -179.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . 0.711 ' HB2' ' HD3' ' B' ' 498' ' ' ARG . 64.4 t80 -103.42 88.5 3.12 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -82.45 46.02 1.01 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.216 178.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 64.2 20.06 12.03 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.275 -176.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 30.6 p . . . . . 0 C--O 1.247 0.968 0 CA-C-N 115.364 -0.835 . . . . 0.0 109.545 179.876 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 68.6 m . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 121.399 0.618 . . . . 0.0 110.507 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 25.8 p-10 -125.55 -37.87 2.3 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.129 179.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -136.94 -36.12 0.69 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.747 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 156.45 177.68 29.84 Favored Glycine 0 N--CA 1.445 -0.726 0 N-CA-C 111.224 -0.751 . . . . 0.0 111.224 -178.416 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 20.3 m 62.06 84.87 0.13 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.297 0.57 . . . . 0.0 110.83 -179.265 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 14.9 m-20 -124.15 164.9 18.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.394 179.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -71.55 -71.65 0.26 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.075 0.464 . . . . 0.0 110.905 -177.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -108.93 -33.41 6.93 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.955 179.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 161.67 -147.07 13.03 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.821 179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -169.46 12.29 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.672 -0.775 . . . . 0.0 112.937 179.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -143.76 -74.8 0.26 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.884 0.342 . . . . 0.0 111.076 179.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . . . . . . . . . 24.0 m -131.43 101.62 15.87 Favored Pre-proline 0 C--N 1.322 -0.589 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.396 -178.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.92 -62.79 0.04 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.795 2.33 . . . . 0.0 111.868 177.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 30.1 m -115.54 141.34 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.436 178.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 9.7 tp60 -115.47 26.85 9.75 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 121.521 0.677 . . . . 0.0 109.712 -179.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -78.61 -1.15 32.81 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.548 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 50.7 mt 72.91 146.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 123.754 0.659 . . . . 0.0 111.297 178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -105.47 -62.37 1.37 Allowed 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.331 176.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 16.0 m -154.11 101.19 2.47 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.09 -178.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.602 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 24.5 Cg_exo -63.85 152.15 81.99 Favored 'Trans proline' 0 C--N 1.343 0.247 0 C-N-CA 122.433 2.089 . . . . 0.0 111.112 172.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -131.38 150.56 52.1 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.894 0.378 . . . . 0.0 111.399 -175.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 7.4 p -93.71 144.5 9.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.383 -179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -77.78 -47.96 17.72 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 121.305 0.574 . . . . 0.0 112.104 -173.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 95.0 mt 71.57 -38.64 0.43 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.19 177.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -65.31 -26.15 67.93 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.571 0.7 . . . . 0.0 109.195 179.009 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -55.93 -24.27 36.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.256 -1.338 . . . . 0.0 112.312 174.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.601 HD11 HD21 ' B' ' 504' ' ' LEU . 75.4 mt -75.47 154.61 36.89 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.237 0.541 . . . . 0.0 111.275 -176.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 -63.66 142.58 58.34 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.342 -0.844 . . . . 0.0 109.695 174.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.59 ' HB ' ' HD3' ' A' ' 175' ' ' LYS . 5.1 p -58.4 -31.67 43.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.875 0.369 . . . . 0.0 110.577 177.4 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -66.32 -38.98 88.95 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.542 175.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.629 HG21 ' HG2' ' B' ' 500' ' ' GLU . 39.0 m -67.92 -40.07 83.44 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.125 -178.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 75.0 mt -63.85 -44.47 93.06 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 121.332 0.587 . . . . 0.0 110.006 177.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -62.59 -33.66 75.41 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.169 176.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.643 ' HD2' ' O ' ' B' ' 495' ' ' VAL . 28.4 ttm180 -67.11 -43.67 81.9 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.078 -179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . 0.519 ' HA ' HG13 ' B' ' 495' ' ' VAL . 69.7 t80 -54.88 -56.31 20.9 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.838 174.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . . . . . . . . . 46.3 mtpt -67.23 -31.84 72.47 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.496 -0.775 . . . . 0.0 111.433 -174.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -73.06 -43.42 61.94 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.705 178.698 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -66.91 -41.67 86.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.546 -178.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . . . . . . . . . 46.4 m-85 -79.98 -4.36 52.19 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.135 178.805 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 56.84 56.65 5.26 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.22 178.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 88.9 mt -88.57 124.04 66.74 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.339 -178.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -59.85 127.71 24.36 Favored 'Trans proline' 0 C--O 1.234 0.281 0 C-N-CA 122.749 2.3 . . . . 0.0 111.548 178.15 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.57 ' HB ' HD11 ' A' ' 173' ' ' LEU . 1.3 p -138.97 159.03 43.11 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.089 0.471 . . . . 0.0 112.135 -175.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . . . . . . . . . 19.3 ptp180 -96.04 149.84 36.48 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.01 176.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.23 145.24 71.72 Favored 'Trans proline' 0 C--O 1.233 0.253 0 C-N-CA 122.757 2.305 . . . . 0.0 112.29 179.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 88.89 46.94 4.35 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.231 177.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . 0.57 HD11 ' HB ' ' A' ' 169' ' ' THR . 99.1 mt -85.7 146.11 26.98 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.223 0.535 . . . . 0.0 111.855 -177.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.549 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 19.7 t-20 -108.15 159.36 16.66 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.471 -0.786 . . . . 0.0 109.725 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.59 ' HD3' ' HB ' ' A' ' 155' ' ' VAL . 21.8 tptm -49.17 -49.27 43.34 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 122.765 0.426 . . . . 0.0 111.143 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.8 -39.92 91.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.101 -179.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -60.27 -39.58 87.34 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.125 178.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.556 ' CD1' HG23 ' A' ' 155' ' ' VAL . 86.3 mt -59.21 -54.68 44.18 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.051 176.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.539 HG23 ' O ' ' A' ' 175' ' ' LYS . 21.5 t -56.93 -40.82 74.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 123.833 0.708 . . . . 0.0 111.296 -176.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -59.7 -50.92 71.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.722 0.296 . . . . 0.0 110.874 178.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 70.8 mt -65.59 -42.88 93.92 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 CA-C-O 120.961 0.41 . . . . 0.0 110.812 179.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.588 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 78.9 t -58.38 -49.29 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.562 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.35 178.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -63.65 -37.02 94.11 Favored Glycine 0 C--N 1.331 0.264 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.575 -178.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 42.4 t -59.42 -45.65 90.94 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.932 0.396 . . . . 0.0 110.684 179.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 47.7 t-80 -83.69 -22.92 31.9 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.048 0.451 . . . . 0.0 110.618 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.588 ' HB2' ' O ' ' A' ' 182' ' ' VAL . 18.0 t80 -65.47 -41.79 92.97 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.747 -178.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -71.63 -11.36 60.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.411 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 4.9 p -116.46 22.91 12.45 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.916 ' HB ' ' HD3' ' B' ' 486' ' ' ARG . 78.2 mt -75.59 125.4 88.63 Favored Pre-proline 0 C--O 1.236 0.359 0 CA-C-O 120.58 0.229 . . . . 0.0 110.456 176.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 189' ' ' ILE . 12.6 Cg_exo -70.18 126.41 13.0 Favored 'Trans proline' 0 N--CA 1.463 -0.298 0 C-N-CA 122.992 2.461 . . . . 0.0 110.963 174.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . . . . . . . . . 3.8 p -147.21 155.26 11.1 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 C-N-CA 120.712 -0.395 . . . . 0.0 110.94 -175.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -136.09 133.03 36.88 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.271 178.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -50.63 -64.67 0.74 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 112.525 0.565 . . . . 0.0 112.525 -176.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . . . . . . . . . 6.0 tmtm? -55.91 -53.61 54.72 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.434 -171.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -61.99 -43.94 97.78 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.743 0.306 . . . . 0.0 111.822 -177.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 33.3 m -68.61 -43.14 77.04 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.237 -174.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . . . . . . . . . 75.3 mt -59.13 -49.91 76.08 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 176.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 24.9 m -57.85 -46.69 84.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.864 -179.528 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 8.5 t -60.38 -49.64 76.77 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.772 -178.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.535 ' CD1' HD22 ' B' ' 488' ' ' LEU . 61.2 t80 -61.93 -54.77 37.3 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.215 -177.052 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.402 ' HA ' ' HZ ' ' B' ' 522' ' ' PHE . 73.6 mt -58.08 -46.05 88.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.198 0.523 . . . . 0.0 110.872 -177.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -62.58 -40.27 96.36 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.152 -176.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 16.5 m -70.67 -54.61 11.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.124 -177.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . . . . . . . . . 43.8 t -61.47 -35.59 67.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . . . . . . . . . 55.9 mtp180 -73.12 -17.6 61.38 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 178.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 5.7 m-80 -92.42 -49.63 6.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.729 0.3 . . . . 0.0 110.973 179.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 4.5 p-10 -169.87 159.82 8.13 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.278 0.561 . . . . 0.0 109.643 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 208' ' ' LYS . 11.7 mptt -87.43 137.62 32.18 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.465 -0.789 . . . . 0.0 109.692 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . 0.521 HD22 ' N ' ' A' ' 209' ' ' ASN . 0.1 OUTLIER -52.53 162.52 0.54 Allowed 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 113.448 0.906 . . . . 0.0 113.448 -174.11 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -128.25 -162.78 1.21 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.386 176.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 18.8 m 70.65 11.06 7.22 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 123.535 0.522 . . . . 0.0 111.199 176.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 19.1 p-10 -97.71 -47.57 5.55 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.151 179.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 54.4 tp -139.16 136.21 34.85 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.738 -0.665 . . . . 0.0 109.773 179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . 0.411 ' N ' ' HD2' ' A' ' 214' ' ' LYS . 0.3 OUTLIER -108.9 140.3 42.56 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.583 -179.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -113.7 -169.25 1.47 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.544 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 63.97 27.98 14.37 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 121.022 0.439 . . . . 0.0 110.967 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 16.0 m -122.17 14.95 10.61 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.758 -178.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 101.95 95.03 2.25 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.899 -178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 12.3 p -142.47 143.96 25.31 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 120.697 0.284 . . . . 0.0 110.578 -178.286 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 8.1 p80 . . . . . 0 C--O 1.247 0.964 0 CA-C-O 118.56 -0.733 . . . . 0.0 110.136 178.784 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 121.219 0.533 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 44.9 t30 -104.74 -49.45 3.52 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.203 -179.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -109.43 162.26 14.53 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.577 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 15.2 m -63.65 133.28 53.37 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.187 177.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 39.7 ttpt -82.8 -70.86 0.52 Allowed 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.817 0.342 . . . . 0.0 110.671 -177.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -155.11 10.24 0.32 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.164 0.507 . . . . 0.0 110.429 -177.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 116.64 -65.14 0.33 Allowed Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 111.469 -0.652 . . . . 0.0 111.469 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 42.9 t -75.04 123.14 30.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 N-CA-C 110.14 -0.319 . . . . 0.0 110.14 177.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . -165.9 -51.62 0.02 OUTLIER Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 120.984 -0.627 . . . . 0.0 111.858 178.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 9.5 t -69.32 -16.06 63.47 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.48 0.181 . . . . 0.0 110.834 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.22 -60.4 3.56 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.79 175.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 39.1 m -65.28 -26.67 68.18 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.88 -178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.71 -52.74 59.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.049 177.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.507 ' O ' HG23 ' B' ' 471' ' ' VAL . 63.7 t80 -54.88 -58.81 6.11 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.614 176.853 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -65.01 -27.63 68.96 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -172.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -71.36 -42.13 68.86 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 120.957 0.408 . . . . 0.0 109.992 176.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . . . . . . . . . 65.2 mttm -61.51 -45.49 93.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.191 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.528 HG13 HD21 ' B' ' 509' ' ' LEU . 84.8 t -55.95 -47.66 79.68 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.172 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.797 177.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -59.41 -40.58 87.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.433 -178.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 65.2 tttp -79.41 -35.02 41.26 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.728 0.299 . . . . 0.0 111.198 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . . . . . . . . . . . -70.91 -46.72 62.03 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.691 -177.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 50.7 mt -61.04 -43.55 98.72 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.494 -179.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' B' ' 476' ' ' ARG . 25.6 ttt180 70.68 -61.2 0.48 Allowed 'General case' 0 N--CA 1.468 0.462 0 O-C-N 124.154 0.909 . . . . 0.0 112.326 172.646 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . . . . . . . . . 30.8 t -62.87 145.19 55.67 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.719 -176.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -65.44 -50.84 63.89 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.627 -177.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -68.61 -24.4 64.57 Favored 'General case' 0 C--O 1.223 -0.315 0 C-N-CA 120.917 -0.313 . . . . 0.0 111.359 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.602 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -64.88 -56.08 15.5 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.053 0.454 . . . . 0.0 110.186 177.077 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.409 ' CE2' HD11 ' B' ' 485' ' ' LEU . 62.4 t80 -66.74 -37.16 84.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.255 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' B' ' 486' ' ' ARG . 34.2 tt0 -63.99 -45.87 87.08 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.438 179.053 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -60.39 -39.84 88.75 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.506 ' O ' ' HG ' ' B' ' 488' ' ' LEU . 67.5 t80 -55.57 -49.91 71.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.135 174.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.409 HD11 ' CE2' ' B' ' 481' ' ' TYR . 88.6 mt -65.06 -33.97 77.31 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.188 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.916 ' HD3' ' HB ' ' A' ' 189' ' ' ILE . 26.1 mtt180 -64.85 -41.3 95.81 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.893 0.377 . . . . 0.0 110.277 177.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 61.4 m -60.87 -34.73 75.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.187 -0.46 . . . . 0.0 109.979 174.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.535 HD22 ' CD1' ' A' ' 200' ' ' PHE . 44.3 mt -66.99 -52.41 42.98 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.086 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' B' ' 486' ' ' ARG . 10.8 m -59.6 -42.24 87.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.161 0 N-CA-C 111.87 0.322 . . . . 0.0 111.87 -177.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.577 ' HA ' ' HG2' ' B' ' 493' ' ' GLN . 17.1 pt -70.47 -32.31 49.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 C-N-CA 120.146 -0.622 . . . . 0.0 111.132 178.871 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -64.97 -45.7 84.61 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.196 0.522 . . . . 0.0 110.176 174.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -63.94 -31.51 72.72 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.029 -177.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . 0.851 ' HG3' HG23 ' B' ' 495' ' ' VAL . 10.7 pt20 -93.68 13.3 22.59 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.303 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 67.6 35.59 4.04 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 115.971 -0.559 . . . . 0.0 112.308 173.505 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.851 HG23 ' HG3' ' B' ' 493' ' ' GLN . 64.8 t -88.8 -52.91 10.4 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 CA-C-O 121.029 0.443 . . . . 0.0 110.061 174.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.422 HG12 HG13 ' B' ' 490' ' ' ILE . 49.5 pt -110.08 145.02 17.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.125 178.641 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . 0.443 ' HB3' ' OE1' ' B' ' 500' ' ' GLU . 15.2 t -84.93 178.49 7.58 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.981 0.419 . . . . 0.0 110.385 -179.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.59 ' O ' HG23 ' B' ' 502' ' ' VAL . 9.5 ttp180 -55.38 -47.7 75.42 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.251 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -59.09 -53.11 62.09 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.162 -179.814 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . 0.629 ' HG2' HG21 ' A' ' 157' ' ' THR . 1.9 mp0 -56.6 -40.31 75.09 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.443 -179.533 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.795 HD23 HD21 ' B' ' 523' ' ' LEU . 67.8 tp -60.03 -49.39 77.84 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 110.939 -179.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.59 HG23 ' O ' ' B' ' 498' ' ' ARG . 8.1 t -68.06 -30.32 47.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.41 -178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -68.47 -46.08 70.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.344 176.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.601 HD21 HD11 ' A' ' 153' ' ' LEU . 86.4 mt -62.37 -40.31 96.03 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.988 -175.739 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . . . . . . . . . 9.8 p -87.23 6.78 2.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-O 121.084 0.468 . . . . 0.0 111.194 -176.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.654 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 40.3 t -56.19 -52.98 68.59 Favored Pre-proline 0 CA--C 1.541 0.605 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.733 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 23.3 Cg_exo -66.58 -7.94 19.5 Favored 'Trans proline' 0 C--N 1.354 0.838 0 C-N-CA 122.055 1.837 . . . . 0.0 113.056 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.473 ' O ' ' HD3' ' B' ' 511' ' ' LYS . 96.5 m-85 -100.15 -50.18 4.05 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.516 -176.12 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.528 HD21 HG13 ' B' ' 471' ' ' VAL . 86.9 mt -106.6 -8.45 16.96 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 121.051 -0.26 . . . . 0.0 111.392 -177.241 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -66.44 -20.17 69.42 Favored Glycine 0 CA--C 1.516 0.141 0 C-N-CA 121.19 -0.529 . . . . 0.0 113.269 -176.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' B' ' 508' ' ' PHE . 0.0 OUTLIER -83.05 -5.11 58.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.745 0.307 . . . . 0.0 110.652 177.797 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.433 ' HA ' ' HD2' ' B' ' 513' ' ' PRO . 58.7 m-85 -118.71 93.23 45.79 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 178.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . 0.433 ' HD2' ' HA ' ' B' ' 512' ' ' PHE . 9.4 Cg_endo -51.8 -54.23 5.66 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.483 2.788 . . . . 0.0 113.673 -174.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -65.1 -44.57 88.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.303 0.573 . . . . 0.0 110.429 -176.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . . . . . . . . . 21.4 tp -63.64 -42.72 98.1 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.797 -176.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -72.09 -31.98 66.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.691 -178.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 11.2 m-80 -70.26 -34.69 73.12 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.685 -0.234 . . . . 0.0 110.506 177.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . . . . . . . . . 6.1 t90 -60.25 -49.22 78.47 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 173.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.664 ' O ' HD12 ' B' ' 523' ' ' LEU . 33.1 t80 -54.98 -53.53 54.58 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.506 179.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -56.17 -40.94 74.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.784 -178.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -63.46 -35.94 82.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.978 0.418 . . . . 0.0 110.459 178.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . 0.402 ' HZ ' ' HA ' ' A' ' 201' ' ' ILE . 60.7 t80 -65.07 -41.4 95.13 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.653 179.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.795 HD21 HD23 ' B' ' 501' ' ' LEU . 3.6 mp -76.98 -15.35 59.67 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.662 -0.245 . . . . 0.0 111.205 178.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 71.62 34.06 63.27 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 110.494 -1.042 . . . . 0.0 110.494 -171.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -97.8 106.62 18.96 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.013 -0.593 . . . . 0.0 110.494 -174.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . 0.484 ' HG2' ' OXT' ' B' ' 528' ' ' SER . 8.9 ptpp? -100.88 39.88 1.34 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.422 -178.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 70.87 8.0 6.4 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 114.825 -1.079 . . . . 0.0 109.497 -169.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . 0.484 ' OXT' ' HG2' ' B' ' 526' ' ' LYS . 32.6 t . . . . . 0 C--O 1.247 0.958 0 CA-C-N 114.576 -1.193 . . . . 0.0 108.187 177.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 N--CA 1.477 0.92 0 CA-C-O 120.767 0.317 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -114.42 123.33 49.17 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -82.61 -2.42 53.76 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.878 0.371 . . . . 0.0 111.584 -175.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . 114.5 30.97 2.27 Favored Glycine 0 N--CA 1.447 -0.567 0 C-N-CA 120.807 -0.711 . . . . 0.0 112.458 178.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 23.6 t -137.45 144.49 42.33 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.853 -0.425 . . . . 0.0 109.853 179.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -119.7 -41.55 2.68 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.062 0.458 . . . . 0.0 110.81 -178.128 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -119.72 -176.22 3.12 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 178.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -57.16 -52.38 65.54 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.709 0.29 . . . . 0.0 111.531 -178.638 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 161.94 40.47 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.668 -0.777 . . . . 0.0 112.067 -178.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 74.06 -115.21 4.83 Favored Glycine 0 N--CA 1.446 -0.67 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.51 179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -97.2 149.24 22.23 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.004 0.431 . . . . 0.0 110.603 -178.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' SER . . . . . 0.473 ' HA ' ' HD3' ' A' ' 139' ' ' PRO . 50.0 m -103.86 128.4 27.35 Favored Pre-proline 0 C--N 1.321 -0.657 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.443 179.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 138' ' ' SER . 21.9 Cg_exo -65.27 -34.66 44.1 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.782 2.321 . . . . 0.0 111.91 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 7.0 m -97.94 107.9 20.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.371 0.605 . . . . 0.0 111.064 179.524 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -112.57 96.32 5.92 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.018 177.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -103.97 125.5 50.4 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.432 -178.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -152.64 113.95 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.384 -177.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' B' ' 477' ' ' SER . 8.0 t70 -62.6 -65.4 0.69 Allowed 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 170.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 30.5 m -154.24 105.7 2.42 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.42 178.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' PRO . . . . . 0.486 ' HD2' ' HB2' ' B' ' 480' ' ' ALA . 19.3 Cg_exo -63.47 148.1 92.81 Favored 'Trans proline' 0 N--CA 1.461 -0.429 0 C-N-CA 122.069 1.846 . . . . 0.0 110.888 173.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -106.32 158.42 16.88 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.828 0.347 . . . . 0.0 111.038 -173.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 4.4 p -110.22 131.79 60.31 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.412 178.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -87.92 124.88 34.14 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 176.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' LEU . . . . . . . . . . . . . 88.6 mt -110.17 5.97 22.35 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -94.01 -15.93 24.38 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 -179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -73.48 -19.5 60.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.028 -0.987 . . . . 0.0 111.397 176.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' LEU . . . . . 0.46 HD11 HD21 ' B' ' 504' ' ' LEU . 72.5 mt -71.41 156.52 39.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.196 0.522 . . . . 0.0 111.39 -177.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' GLN . . . . . . . . . . . . . 66.4 mt-30 -69.98 158.75 35.05 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.365 178.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 46.3 t -63.51 -41.4 92.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.089 -0.505 . . . . 0.0 109.81 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -64.98 -39.78 93.98 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.714 -0.676 . . . . 0.0 110.507 -179.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' THR . . . . . 0.432 ' CG2' HG22 ' B' ' 496' ' ' ILE . 25.0 m -57.36 -47.91 80.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.096 179.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.35 -41.86 96.53 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.684 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ARG . . . . . . . . . . . . . 74.7 mtp180 -65.98 -33.52 75.99 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.623 178.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' ARG . . . . . 0.472 ' HD3' ' O ' ' B' ' 495' ' ' VAL . 17.9 ttt85 -67.29 -44.4 79.36 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.212 179.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -53.47 -49.98 66.3 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.444 172.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' LYS . . . . . 0.599 ' HE2' HG21 ' A' ' 169' ' ' THR . 9.1 mtpm? -56.9 -42.17 79.41 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.802 -179.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 40.0 mtp180 -72.94 -47.65 43.69 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.602 -178.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -71.79 -31.58 66.75 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.042 -173.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' PHE . . . . . 0.426 ' CE1' HG22 ' B' ' 490' ' ' ILE . 32.3 m-85 -93.29 1.96 56.78 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.726 -0.215 . . . . 0.0 111.064 178.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp 58.2 73.95 0.45 Allowed 'General case' 0 C--O 1.234 0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.448 175.69 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.421 ' HA ' ' HD2' ' A' ' 168' ' ' PRO . 92.4 mt -114.73 107.66 50.28 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.415 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' PRO . . . . . 0.421 ' HD2' ' HA ' ' A' ' 167' ' ' LEU . 37.5 Cg_endo -67.01 126.2 14.82 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.404 2.069 . . . . 0.0 111.419 178.484 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' THR . . . . . 0.599 HG21 ' HE2' ' A' ' 162' ' ' LYS . 15.0 p -136.55 165.26 26.28 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.266 -175.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' ARG . . . . . 0.414 HH11 ' HD2' ' A' ' 170' ' ' ARG . 47.8 mtt180 -99.61 149.04 35.53 Favored Pre-proline 0 C--N 1.324 -0.532 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.401 -176.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -60.53 137.33 73.12 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.849 2.366 . . . . 0.0 112.245 178.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' GLY . . . . . . . . . . . . . . . 110.26 36.54 1.94 Allowed Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 111.415 -0.674 . . . . 0.0 111.415 -177.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' LEU . . . . . . . . . . . . . 89.8 mt -86.36 144.38 27.38 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.135 0.493 . . . . 0.0 111.386 -176.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' ASN . . . . . 0.631 ' O ' ' HG ' ' A' ' 178' ' ' LEU . 59.4 m-80 -136.18 177.05 8.14 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.689 179.595 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.581 ' O ' HG23 ' A' ' 179' ' ' VAL . 20.9 tptm -53.03 -56.07 18.91 Favored 'General case' 0 C--N 1.328 -0.338 0 O-C-N 123.405 0.44 . . . . 0.0 111.791 -176.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 176' ' ' ALA . . . . . . . . . . . . . . . -59.67 -35.5 74.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.427 . . . . 0.0 111.182 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.413 ' HB2' ' H ' ' A' ' 174' ' ' ASN . 14.6 mm-40 -66.63 -46.83 74.54 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.271 -179.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 178' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 174' ' ' ASN . 69.7 mt -60.04 -48.02 83.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.288 -179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 179' ' ' VAL . . . . . 0.581 HG23 ' O ' ' A' ' 175' ' ' LYS . 49.0 t -58.27 -43.33 85.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.943 -178.336 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 13.7 mm-40 -59.98 -45.94 91.05 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.581 177.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 181' ' ' ILE . . . . . . . . . . . . . 72.5 mt -66.43 -47.64 83.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.648 0 CA-C-O 120.994 0.426 . . . . 0.0 110.616 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 182' ' ' VAL . . . . . 0.472 ' O ' ' HB2' ' A' ' 186' ' ' PHE . 74.1 t -59.87 -49.58 83.36 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.414 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.499 179.563 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 183' ' ' GLY . . . . . . . . . . . . . . . -61.53 -40.49 98.78 Favored Glycine 0 C--N 1.33 0.226 0 C-N-CA 121.412 -0.423 . . . . 0.0 112.255 -179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 184' ' ' CYS . . . . . . . . . . . . . 44.2 t -54.91 -48.55 72.93 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.807 0.337 . . . . 0.0 110.947 178.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 185' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -83.64 -24.95 31.17 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.803 0.335 . . . . 0.0 111.051 -177.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 186' ' ' PHE . . . . . 0.508 ' HE1' HD13 ' B' ' 490' ' ' ILE . 39.1 t80 -64.72 -39.43 93.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 122.87 0.468 . . . . 0.0 110.963 -178.395 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 187' ' ' LYS . . . . . . . . . . . . . 55.4 mtpt -74.75 5.53 4.86 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.682 -179.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 188' ' ' SER . . . . . . . . . . . . . 12.4 p -133.43 24.02 4.08 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.659 0.266 . . . . 0.0 111.477 -177.647 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 189' ' ' ILE . . . . . 0.587 ' HB ' ' HG3' ' B' ' 486' ' ' ARG . 68.4 mt -86.73 117.69 69.03 Favored Pre-proline 0 C--O 1.234 0.254 0 C-N-CA 121.097 -0.241 . . . . 0.0 110.612 177.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 190' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_exo -67.66 122.59 9.78 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.808 2.339 . . . . 0.0 111.168 175.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 191' ' ' VAL . . . . . 0.574 HG21 ' HB3' ' B' ' 485' ' ' LEU . 8.4 p -134.5 147.36 29.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-O 120.906 0.384 . . . . 0.0 110.97 -175.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 192' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -118.04 118.47 32.01 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.142 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 193' ' ' GLU . . . . . 0.504 ' O ' ' HG ' ' A' ' 197' ' ' LEU . 86.8 tt0 -48.78 -58.78 4.26 Favored 'General case' 0 C--N 1.326 -0.421 0 O-C-N 123.698 0.624 . . . . 0.0 112.633 -173.458 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 194' ' ' LYS . . . . . 0.407 ' HD2' ' C ' ' A' ' 194' ' ' LYS . 0.5 OUTLIER -64.68 -49.18 71.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.497 0.189 . . . . 0.0 111.166 -173.368 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 195' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -64.0 -46.51 84.2 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.792 0.329 . . . . 0.0 111.369 -176.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 196' ' ' THR . . . . . . . . . . . . . 85.5 m -63.03 -41.28 99.49 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.43 -177.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 193' ' ' GLU . 59.1 mt -60.42 -46.37 90.24 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 175.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' THR . . . . . . . . . . . . . 47.2 m -58.61 -46.68 86.51 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.732 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 199' ' ' CYS . . . . . . . . . . . . . 66.1 m -57.05 -54.61 44.84 Favored 'General case' 0 CA--C 1.518 -0.252 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.545 177.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 200' ' ' PHE . . . . . 0.517 ' CD1' HD22 ' B' ' 488' ' ' LEU . 76.7 t80 -56.56 -53.11 61.37 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.348 -177.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ILE . . . . . 0.404 HG13 ' O ' ' A' ' 197' ' ' LEU . 74.7 mt -55.85 -52.09 52.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.484 -175.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -70.51 -25.94 63.36 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -176.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' SER . . . . . . . . . . . . . 49.2 m -72.17 -46.36 56.67 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.706 178.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 200' ' ' PHE . 22.0 t -76.2 -35.33 27.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.731 -0.213 . . . . 0.0 111.204 -175.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' ARG . . . . . 0.568 ' HD2' ' OE2' ' B' ' 464' ' ' GLU . 17.9 mtp180 -64.94 -44.76 88.41 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.696 0.284 . . . . 0.0 111.068 178.036 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 206' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -95.04 80.98 3.65 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.691 -0.231 . . . . 0.0 110.544 -179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 13.4 t70 67.47 124.31 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.53 0.732 . . . . 0.0 111.205 -176.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 208' ' ' LYS . . . . . 0.62 ' HB3' ' HD3' ' B' ' 498' ' ' ARG . 0.3 OUTLIER -87.77 22.07 2.42 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.967 -0.561 . . . . 0.0 112.251 -170.183 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 209' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 65.03 91.5 0.08 Allowed 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 121.302 0.573 . . . . 0.0 110.494 -179.813 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 210' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.35 85.02 2.33 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.182 -177.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 211' ' ' SER . . . . . . . . . . . . . 4.8 p -73.76 -30.8 63.0 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.541 173.303 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 212' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 73.53 -36.28 0.34 Allowed 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 114.808 -1.087 . . . . 0.0 112.854 172.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 213' ' ' LEU . . . . . . . . . . . . . 83.7 mt 60.49 94.66 0.04 OUTLIER 'General case' 0 C--O 1.232 0.179 0 CA-C-O 121.53 0.681 . . . . 0.0 110.831 -177.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 214' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -126.16 -0.37 7.11 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.494 -0.776 . . . . 0.0 111.05 -175.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 215' ' ' ALA . . . . . . . . . . . . . . . -91.23 82.62 5.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.102 0.477 . . . . 0.0 110.982 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 216' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -110.1 -19.79 12.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.378 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 217' ' ' SER . . . . . . . . . . . . . 31.2 t -108.31 137.24 46.62 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.003 179.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 218' ' ' GLY . . . . . . . . . . . . . . . 172.51 -19.32 0.06 OUTLIER Glycine 0 N--CA 1.447 -0.57 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.858 179.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 219' ' ' VAL . . . . . . . . . . . . . 22.5 m -119.76 150.56 22.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 O-C-N 122.535 -0.391 . . . . 0.0 111.358 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 220' ' ' HIS . . . . . . . . . . . . . 44.1 t-80 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.724 -0.655 . . . . 0.0 109.554 179.378 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 454' ' ' SER . . . . . . . . . . . . . 23.2 t . . . . . 0 N--CA 1.474 0.772 0 CA-C-O 120.804 0.335 . . . . 0.0 110.305 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 455' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -71.75 -48.35 47.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.342 178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 456' ' ' ALA . . . . . . . . . . . . . . . -86.21 154.79 21.05 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.479 179.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 457' ' ' SER . . . . . . . . . . . . . 20.4 t -117.88 160.17 21.86 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.092 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 458' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -97.64 -51.64 4.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.881 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 459' ' ' HIS . . . . . . . . . . . . . 42.8 m-70 -135.22 2.35 3.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.607 -0.27 . . . . 0.0 111.675 -178.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . 77.44 -52.28 3.43 Favored Glycine 0 CA--C 1.517 0.191 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.076 -176.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 40.8 t -76.39 136.67 24.19 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 462' ' ' GLY . . . . . . . . . . . . . . . 131.01 38.25 0.29 Allowed Glycine 0 N--CA 1.445 -0.707 0 C-N-CA 120.841 -0.695 . . . . 0.0 111.815 -177.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 463' ' ' THR . . . . . . . . . . . . . 26.4 p -81.16 3.65 22.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.715 0.293 . . . . 0.0 110.947 -178.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 464' ' ' GLU . . . . . 0.568 ' OE2' ' HD2' ' A' ' 205' ' ' ARG . 1.7 mp0 -54.98 -44.45 74.46 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.472 175.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 465' ' ' SER . . . . . . . . . . . . . 23.0 t -60.5 -40.35 91.06 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.023 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 466' ' ' LEU . . . . . 0.535 HD21 ' HE3' ' B' ' 470' ' ' LYS . 8.9 tt -62.14 -49.33 76.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.798 177.172 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 467' ' ' PHE . . . . . 0.526 ' O ' HG23 ' B' ' 471' ' ' VAL . 75.5 t80 -54.16 -58.04 8.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.894 -0.593 . . . . 0.0 111.721 176.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 468' ' ' PHE . . . . . 0.4 ' HE1' ' HZ ' ' B' ' 484' ' ' PHE . 46.1 m-85 -64.54 -29.59 70.62 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 112.186 0.439 . . . . 0.0 112.186 -174.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 469' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.01 -45.04 78.75 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 470' ' ' LYS . . . . . 0.535 ' HE3' HD21 ' B' ' 466' ' ' LEU . 89.8 mttt -64.31 -40.14 95.32 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.701 175.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 471' ' ' VAL . . . . . 0.526 HG23 ' O ' ' B' ' 467' ' ' PHE . 87.1 t -59.79 -42.19 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 120.796 0.332 . . . . 0.0 110.499 176.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 472' ' ' ARG . . . . . . . . . . . . . 2.6 mmt180 -57.49 -46.36 83.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.921 177.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 473' ' ' LYS . . . . . . . . . . . . . 18.2 ttmm -75.67 -34.35 60.46 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.375 -179.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 474' ' ' ALA . . . . . 0.43 ' HB1' ' CE2' ' B' ' 512' ' ' PHE . . . -69.75 -53.8 16.71 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.967 -175.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 475' ' ' LEU . . . . . . . . . . . . . 10.1 mp -67.46 -33.98 76.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.207 -176.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 476' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 69.2 -59.48 0.48 Allowed 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.962 0.789 . . . . 0.0 112.04 179.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 477' ' ' SER . . . . . 0.577 ' HB2' ' O ' ' A' ' 144' ' ' ASP . 30.5 t -62.52 126.68 28.18 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.057 0.456 . . . . 0.0 111.261 -178.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -67.07 -30.36 70.39 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.023 177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 479' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -72.79 -40.71 65.68 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.924 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 480' ' ' ALA . . . . . 0.486 ' HB2' ' HD2' ' A' ' 146' ' ' PRO . . . -63.46 -43.41 97.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.468 176.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 481' ' ' TYR . . . . . 0.469 ' O ' ' HG ' ' B' ' 485' ' ' LEU . 47.2 t80 -66.53 -38.53 87.38 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.081 178.043 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 482' ' ' GLU . . . . . 0.515 ' HG3' ' CG1' ' A' ' 191' ' ' VAL . 37.8 tt0 -60.62 -40.48 92.05 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.204 175.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 483' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.43 -42.52 99.52 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 179.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 484' ' ' PHE . . . . . 0.4 ' HZ ' ' HE1' ' B' ' 468' ' ' PHE . 46.6 t80 -55.74 -42.61 75.64 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.384 172.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 485' ' ' LEU . . . . . 0.574 ' HB3' HG21 ' A' ' 191' ' ' VAL . 92.1 mt -66.99 -32.97 74.56 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.198 179.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 486' ' ' ARG . . . . . 0.587 ' HG3' ' HB ' ' A' ' 189' ' ' ILE . 0.2 OUTLIER -59.68 -43.24 94.08 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.113 0.482 . . . . 0.0 110.059 172.591 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 487' ' ' CYS . . . . . . . . . . . . . 34.4 m -60.84 -35.67 77.16 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.155 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 488' ' ' LEU . . . . . 0.517 HD22 ' CD1' ' A' ' 200' ' ' PHE . 41.9 mt -68.52 -46.17 70.3 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.586 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 489' ' ' VAL . . . . . . . . . . . . . 15.9 m -65.34 -42.06 92.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 C-N-CA 120.815 -0.354 . . . . 0.0 111.555 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 490' ' ' ILE . . . . . 0.508 HD13 ' HE1' ' A' ' 186' ' ' PHE . 11.3 pt -69.98 -29.64 41.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 C-N-CA 120.526 -0.469 . . . . 0.0 110.926 178.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 491' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -68.23 -42.4 79.81 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 121.225 0.536 . . . . 0.0 109.789 172.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 492' ' ' ASN . . . . . . . . . . . . . 37.2 t30 -59.24 -41.29 88.41 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.381 -0.827 . . . . 0.0 111.126 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -89.01 18.02 5.27 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.89 -0.595 . . . . 0.0 111.169 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 494' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 54.28 48.19 21.35 Favored 'General case' 0 C--O 1.232 0.179 0 C-N-CA 123.419 0.688 . . . . 0.0 111.765 178.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 495' ' ' VAL . . . . . 0.472 ' O ' ' HD3' ' A' ' 160' ' ' ARG . 83.2 t -98.21 -42.45 11.29 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.85 175.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 496' ' ' ILE . . . . . 0.432 HG22 ' CG2' ' A' ' 157' ' ' THR . 41.7 pt -115.82 151.23 17.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.695 175.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 497' ' ' SER . . . . . . . . . . . . . 78.2 p -89.84 177.29 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 120.624 0.249 . . . . 0.0 110.5 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 498' ' ' ARG . . . . . 0.62 ' HD3' ' HB3' ' A' ' 208' ' ' LYS . 22.9 mtm180 -52.38 -54.17 35.33 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.449 178.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 499' ' ' ALA . . . . . . . . . . . . . . . -56.66 -48.48 77.5 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.49 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 500' ' ' GLU . . . . . . . . . . . . . 11.0 mm-40 -57.13 -39.81 75.89 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.722 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 501' ' ' LEU . . . . . 0.573 HD23 HD21 ' B' ' 523' ' ' LEU . 53.7 tp -62.95 -47.4 83.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.268 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 502' ' ' VAL . . . . . 0.502 HG13 ' HD2' ' B' ' 519' ' ' PHE . 0.2 OUTLIER -64.62 -31.3 53.09 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 CA-C-O 121.266 0.555 . . . . 0.0 109.923 -179.629 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 503' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -67.26 -45.86 75.42 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.604 179.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 504' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 153' ' ' LEU . 77.9 mt -64.2 -41.53 97.03 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -175.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 505' ' ' VAL . . . . . 0.412 HG22 ' HG ' ' B' ' 509' ' ' LEU . 8.3 p -85.37 3.8 3.59 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 CA-C-O 120.931 0.396 . . . . 0.0 111.113 -178.145 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 506' ' ' SER . . . . . 0.597 ' HB3' ' HD3' ' B' ' 507' ' ' PRO . 22.9 t -55.7 -51.54 79.39 Favored Pre-proline 0 CA--C 1.54 0.562 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.057 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 507' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' B' ' 506' ' ' SER . 50.4 Cg_exo -57.03 -35.04 98.78 Favored 'Trans proline' 0 C--N 1.356 0.954 0 C-N-CA 121.877 1.718 . . . . 0.0 112.486 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 508' ' ' PHE . . . . . 0.406 ' HD2' ' HA ' ' B' ' 505' ' ' VAL . 83.4 m-85 -73.74 -40.86 63.21 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.27 -174.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 509' ' ' LEU . . . . . 0.412 ' HG ' HG22 ' B' ' 505' ' ' VAL . 81.2 mt -101.95 4.71 40.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.82 0.343 . . . . 0.0 111.242 -176.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 510' ' ' GLY . . . . . . . . . . . . . . . -67.48 -18.41 69.75 Favored Glycine 0 N--CA 1.455 -0.068 0 C-N-CA 121.251 -0.5 . . . . 0.0 112.766 -177.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 511' ' ' LYS . . . . . 0.456 ' N ' ' HD2' ' B' ' 511' ' ' LYS . 2.6 mptp? -93.78 -4.71 49.78 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.076 0.465 . . . . 0.0 109.79 178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 512' ' ' PHE . . . . . 0.43 ' CE2' ' HB1' ' B' ' 474' ' ' ALA . 43.7 m-85 -129.56 87.28 53.35 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.644 -172.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 513' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -54.55 -43.45 58.84 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 123.229 2.619 . . . . 0.0 113.18 -176.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 514' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.69 -44.4 96.58 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 121.133 0.492 . . . . 0.0 110.709 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 515' ' ' LEU . . . . . 0.461 HD12 ' HA ' ' B' ' 515' ' ' LEU . 1.4 tp -69.28 -46.61 66.8 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.423 -173.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 516' ' ' PHE . . . . . 0.511 ' CE2' ' HE3' ' B' ' 520' ' ' LYS . 44.5 t80 -66.78 -36.38 82.27 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.907 0.384 . . . . 0.0 110.623 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 517' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -69.69 -41.55 75.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.545 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 518' ' ' TRP . . . . . 0.439 ' HH2' ' HG3' ' B' ' 464' ' ' GLU . 29.3 t90 -55.14 -48.21 74.02 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.214 -0.662 . . . . 0.0 109.214 175.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 519' ' ' PHE . . . . . 0.567 ' O ' HD13 ' B' ' 523' ' ' LEU . 19.0 t80 -56.99 -46.96 81.87 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.25 -0.887 . . . . 0.0 110.622 -179.207 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 520' ' ' LYS . . . . . 0.511 ' HE3' ' CE2' ' B' ' 516' ' ' PHE . 83.1 mttt -56.33 -50.42 71.53 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.259 177.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 521' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -63.14 -32.81 74.28 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.452 -175.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 16.4 t80 -69.15 -44.12 72.96 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-O 121.369 0.604 . . . . 0.0 109.5 -178.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 523' ' ' LEU . . . . . 0.573 HD21 HD23 ' B' ' 501' ' ' LEU . 9.7 mp -73.95 -19.72 60.59 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.674 178.482 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 524' ' ' GLY . . . . . . . . . . . . . . . 85.23 13.99 69.94 Favored Glycine 0 N--CA 1.449 -0.452 0 N-CA-C 111.383 -0.687 . . . . 0.0 111.383 -177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 525' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -82.98 118.51 23.55 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.186 0.517 . . . . 0.0 110.455 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 526' ' ' LYS . . . . . . . . . . . . . 35.6 mtmm -134.02 40.51 3.06 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.659 -179.54 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 527' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 58.1 28.46 16.42 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.565 -179.231 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 528' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.723 -0.655 . . . . 0.0 110.177 -175.839 . . . . . . . . 0 0 . 1 stop_ save_